2-(azepan-1-ium-1-yl)ethyl N-(3-propoxyphenyl)carbamate chloride

Systemtic Name: 2-(azepan-1-ium-1-yl)ethyl N-(3-propoxyphenyl)carbamate chloride Openeye Name: 2-(azepan-1-ium-1-yl)ethyl N-(3-propoxyphenyl)carbamate chloride CAS Name: N-(3-propoxyphenyl)carbamic acid 2-(1-azepan-1-iumyl)ethyl ester chloride IUPAC Name: 2-(azepan-1-ium-1-yl)ethyl N-(3-propoxyphenyl)carbamate chloride Traditional Name: N-(3-propoxyphenyl)carbamic acid 2-(azepan-1-ium-1-yl)ethyl ester chloride Formula: C18H29ClN2O3 MolecularWeight: 356.88746

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)NC(=O)OCC[NH+]2CCCCCC2.[Cl-]

Isomeric SMILES

CCCOC1=CC=CC(=C1)NC(=O)OCC[NH+]2CCCCCC2.[Cl-]

InChI

InChI=1S/C18H28N2O3.ClH/c1-2-13-22-17-9-7-8-16(15-17)19-18(21)23-14-12-20-10-5-3-4-6-11-20;/h7-9,15H,2-6,10-14H2,1H3,(H,19,21);1H