[2-oxidanylidene-2-(1-thiophen-2-ylethylamino)ethyl] 3,4-dimethylbenzoate

Systemtic Name: [2-oxidanylidene-2-(1-thiophen-2-ylethylamino)ethyl] 3,4-dimethylbenzoate Openeye Name: [2-oxo-2-[1-(2-thienyl)ethylamino]ethyl] 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid [2-oxo-2-(1-thiophen-2-ylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(1-thiophen-2-ylethylamino)ethyl] 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid [2-keto-2-[1-(2-thienyl)ethylamino]ethyl] ester Formula: C17H19NO3S MolecularWeight: 317.40266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)NC(C)C2=CC=CS2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)NC(C)C2=CC=CS2)C

InChI

InChI=1S/C17H19NO3S/c1-11-6-7-14(9-12(11)2)17(20)21-10-16(19)18-13(3)15-5-4-8-22-15/h4-9,13H,10H2,1-3H3,(H,18,19)