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

Systemtic Name: 2-(2-chloroethylamino)ethyl 3,4,5-triethoxybenzoate hydrochloride Openeye Name: 2-(2-chloroethylamino)ethyl 3,4,5-triethoxybenzoate hydrochloride CAS Name: 3,4,5-triethoxybenzoic acid 2-(2-chloroethylamino)ethyl ester hydrochloride IUPAC Name: 2-(2-chloroethylamino)ethyl 3,4,5-triethoxybenzoate hydrochloride Traditional Name: 3,4,5-triethoxybenzoic acid 2-(2-chloroethylamino)ethyl ester hydrochloride Formula: C17H27Cl2NO5 MolecularWeight: 396.30598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCCNCCCl.Cl

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCCNCCCl.Cl

InChI

InChI=1S/C17H26ClNO5.ClH/c1-4-21-14-11-13(17(20)24-10-9-19-8-7-18)12-15(22-5-2)16(14)23-6-3;/h11-12,19H,4-10H2,1-3H3;1H