(2-oxidanylidene-2-thiophen-2-yl-ethyl) (3S)-1-(2,6-diethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) (3S)-1-(2,6-diethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] (3S)-1-(2,6-diethylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2,6-diethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) (3S)-1-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(2,6-diethylphenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)N2CC(CC2=O)C(=O)OCC(=O)C3=CC=CS3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)N2C[C@H](CC2=O)C(=O)OCC(=O)C3=CC=CS3

InChI

InChI=1S/C21H23NO4S/c1-3-14-7-5-8-15(4-2)20(14)22-12-16(11-19(22)24)21(25)26-13-17(23)18-9-6-10-27-18/h5-10,16H,3-4,11-13H2,1-2H3/t16-/m0/s1