2-{[3-Ethoxy-2-(ethoxycarbonyl)-3-oxoprop-1-en-1-yl]amino}benzoic acid structure

2-{[3-Ethoxy-2-(ethoxycarbonyl)-3-oxoprop-1-en-1-yl]amino}benzoic acid

2-[(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)amino]benzoic acid

Also Known As: CBMicro_001606|BIM-0001706.P001|AE-641/14179117|SR-01000228982-1|2-{[2,2-bis(ethoxycarbonyl)vinyl]amino}benzoic acid|2-{[3-ethoxy-2-(ethoxycarbonyl)-3-oxoprop-1-en-1-yl]amino}benzoic acid|2-[(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)amino]benzoic acid|2-((3-ethoxy-2-(ethoxycarbonyl)-3-oxoprop-1-en-1-yl)amino)benzoic acid|2-{[3-ethoxy-2-(ethoxycarbonyl)-3-oxo-1-propen-1-yl]amino}benzoic acid|2-{[3-ethoxy-2-(ethoxycarbonyl)-3-oxo-1-propenyl]amino}benzoic acid

CAS: 52693-18-2
Molecular Formula C15H17NO6
Molecular Weight 307.1056 g/mol
LogP 1.8068
Topological Polar Surface Area 101.93 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 7
Exact Mass 307.1056
Monoisotopic Mass 307.1056
Heavy Atoms 22
Complexity 573.4504

Chemical Identifiers

CAS Number 52693-18-2
SMILES CCOC(=O)C(=CNC1=CC=CC=C1C(=O)O)C(=O)OCC

Product Overview

2-{[3-Ethoxy-2-(ethoxycarbonyl)-3-oxoprop-1-en-1-yl]amino}benzoic acid (CAS 52693-18-2), with molecular formula C15H17NO6 and molecular weight 307.1056 g/mol. IUPAC: 2-[(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)amino]benzoic acid.

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2-{[3-Ethoxy-2-(ethoxycarbonyl)-3-oxoprop-1-en-1-yl]amino}benzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.

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