Compound C22H21NO8

2-[6-methyl-5-(3,4,5-trimethoxybenzoyl)-[1,3]dioxolo[4,5-f]indol-7-yl]acetic acid

CAS: 50332-06-4

Molecular Formula	`C22H21NO8`
Molecular Weight	427.4 g/mol
LogP	3.1
Topological Polar Surface Area	105.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	6
Exact Mass	427.1267
Heavy Atoms	31
Complexity	660.0

Chemical Identifiers

CAS Number	50332-06-4
SMILES	`CC1=C(C2=CC3=C(C=C2N1C(=O)C4=CC(=C(C(=C4)OC)OC)OC)OCO3)CC(=O)O`
InChIKey	`WLTPXYFSXYGATR-UHFFFAOYSA-N`

📖 Product Overview

Compound C22H21NO8 (CAS: 50332-06-4) is a chemical compound with molecular formula C22H21NO8 and molecular weight 427.4 g/mol. Its IUPAC systematic name is 2-[6-methyl-5-(3,4,5-trimethoxybenzoyl)-[1,3]dioxolo[4,5-f]indol-7-yl]acetic acid. LogP 3.1 Topological Polar Surface Area 105.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 8 Rotatable Bonds 6 Exact Mass 427.1267 Heavy Atoms 31 Complexity 660.0 InChI Key: WLTPXYFSXYGATR-UHFFFAOYSA-N. SMILES: CC1=C(C2=CC3=C(C=C2N1C(=O)C4=CC(=C(C(=C4)OC)OC)OC)OCO3)CC(=O)O.

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