2-(2-chloroethylamino)ethyl 3,4-dimethoxybenzoate

Systemtic Name: 2-(2-chloroethylamino)ethyl 3,4-dimethoxybenzoate Openeye Name: 2-(2-chloroethylamino)ethyl 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid 2-(2-chloroethylamino)ethyl ester IUPAC Name: 2-(2-chloroethylamino)ethyl 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid 2-(2-chloroethylamino)ethyl ester Formula: C13H18ClNO4 MolecularWeight: 287.73932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCCNCCCl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCCNCCCl)OC

InChI

InChI=1S/C13H18ClNO4/c1-17-11-4-3-10(9-12(11)18-2)13(16)19-8-7-15-6-5-14/h3-4,9,15H,5-8H2,1-2H3