Compound C29H36ClN3O6

2-(2-ethoxy-3-methoxyphenyl)ethyl-bis[2-(phenylcarbamoyloxy)ethyl]azanium chloride

CAS: 27467-06-7

Molecular Formula	`C29H36ClN3O6`
Molecular Weight	558.1 g/mol
Topological Polar Surface Area	99.6 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	7
Rotatable Bonds	16
Exact Mass	557.22925
Heavy Atoms	39
Complexity	631.0

Chemical Identifiers

CAS Number	27467-06-7
SMILES	`CCOC1=C(C=CC=C1OC)CC[NH+](CCOC(=O)NC2=CC=CC=C2)CCOC(=O)NC3=CC=CC=C3.[Cl-]`
InChIKey	`XNTKAUVCFYTMQO-UHFFFAOYSA-N`

📖 Product Overview

Compound C29H36ClN3O6 (CAS: 27467-06-7) is a chemical compound with molecular formula C29H36ClN3O6 and molecular weight 558.1 g/mol. Its IUPAC systematic name is 2-(2-ethoxy-3-methoxyphenyl)ethyl-bis[2-(phenylcarbamoyloxy)ethyl]azanium chloride. Topological Polar Surface Area 99.6 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 7 Rotatable Bonds 16 Exact Mass 557.22925 Heavy Atoms 39 Complexity 631.0 InChI Key: XNTKAUVCFYTMQO-UHFFFAOYSA-N. SMILES: CCOC1=C(C=CC=C1OC)CC[NH+](CCOC(=O)NC2=CC=CC=C2)CCOC(=O)NC3=CC=CC=C3.[Cl-].

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