[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 2,4,5-trimethoxybenzoate

Systemtic Name: [2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 2,4,5-trimethoxybenzoate Openeye Name: [2-oxo-2-[2-(2-thienyl)ethylamino]ethyl] 2,4,5-trimethoxybenzoate CAS Name: 2,4,5-trimethoxybenzoic acid [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] 2,4,5-trimethoxybenzoate Traditional Name: 2,4,5-trimethoxybenzoic acid [2-keto-2-[2-(2-thienyl)ethylamino]ethyl] ester Formula: C18H21NO6S MolecularWeight: 379.42744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCC(=O)NCCC2=CC=CS2)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCC(=O)NCCC2=CC=CS2)OC)OC

InChI

InChI=1S/C18H21NO6S/c1-22-14-10-16(24-3)15(23-2)9-13(14)18(21)25-11-17(20)19-7-6-12-5-4-8-26-12/h4-5,8-10H,6-7,11H2,1-3H3,(H,19,20)