[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 2-(3,4-diethoxyphenyl)carbonylbenzoate

Systemtic Name: [2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 2-(3,4-diethoxyphenyl)carbonylbenzoate Openeye Name: [2-oxo-2-[2-(2-thienyl)ethylamino]ethyl] 2-(3,4-diethoxybenzoyl)benzoate CAS Name: 2-[(3,4-diethoxyphenyl)-oxomethyl]benzoic acid [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] 2-(3,4-diethoxybenzoyl)benzoate Traditional Name: 2-(3,4-diethoxybenzoyl)benzoic acid [2-keto-2-[2-(2-thienyl)ethylamino]ethyl] ester Formula: C26H27NO6S MolecularWeight: 481.56068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC(=O)NCCC3=CC=CS3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC(=O)NCCC3=CC=CS3)OCC

InChI

InChI=1S/C26H27NO6S/c1-3-31-22-12-11-18(16-23(22)32-4-2)25(29)20-9-5-6-10-21(20)26(30)33-17-24(28)27-14-13-19-8-7-15-34-19/h5-12,15-16H,3-4,13-14,17H2,1-2H3,(H,27,28)