[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3,4-dimethylbenzoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3,4-dimethylbenzoate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C16H17NO3S MolecularWeight: 303.37608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)NCC2=CC=CS2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)NCC2=CC=CS2)C

InChI

InChI=1S/C16H17NO3S/c1-11-5-6-13(8-12(11)2)16(19)20-10-15(18)17-9-14-4-3-7-21-14/h3-8H,9-10H2,1-2H3,(H,17,18)