2-(2-chloroethylamino)ethyl 3,4,5-trimethoxybenzoate hydrochloride

Systemtic Name: 2-(2-chloroethylamino)ethyl 3,4,5-trimethoxybenzoate hydrochloride Openeye Name: 2-(2-chloroethylamino)ethyl 3,4,5-trimethoxybenzoate hydrochloride CAS Name: 3,4,5-trimethoxybenzoic acid 2-(2-chloroethylamino)ethyl ester hydrochloride IUPAC Name: 2-(2-chloroethylamino)ethyl 3,4,5-trimethoxybenzoate hydrochloride Traditional Name: 3,4,5-trimethoxybenzoic acid 2-(2-chloroethylamino)ethyl ester hydrochloride Formula: C14H21Cl2NO5 MolecularWeight: 354.22624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OCCNCCCl.Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OCCNCCCl.Cl

InChI

InChI=1S/C14H20ClNO5.ClH/c1-18-11-8-10(9-12(19-2)13(11)20-3)14(17)21-7-6-16-5-4-15;/h8-9,16H,4-7H2,1-3H3;1H