[2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl] 3,4-dimethoxybenzoate

Systemtic Name: [2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl] 3,4-dimethoxybenzoate Openeye Name: [2-oxo-2-(2-phenylsulfanylanilino)ethyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [2-oxo-2-[2-(phenylthio)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylanilino)ethyl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [2-keto-2-[2-(phenylthio)anilino]ethyl] ester Formula: C23H21NO5S MolecularWeight: 423.48154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC=CC=C2SC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC=CC=C2SC3=CC=CC=C3)OC

InChI

InChI=1S/C23H21NO5S/c1-27-19-13-12-16(14-20(19)28-2)23(26)29-15-22(25)24-18-10-6-7-11-21(18)30-17-8-4-3-5-9-17/h3-14H,15H2,1-2H3,(H,24,25)