(2-oxidanylidene-2-thiophen-2-yl-ethyl) 2-(4-chlorophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 2-(4-chlorophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 2-(4-chlorophenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-chlorophenyl)-1,3-dioxo-5-isoindolecarboxylic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 2-(4-chlorophenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(4-chlorophenyl)-1,3-diketo-isoindoline-5-carboxylic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C21H12ClNO5S MolecularWeight: 425.84168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CSC(=C1)C(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H12ClNO5S/c22-13-4-6-14(7-5-13)23-19(25)15-8-3-12(10-16(15)20(23)26)21(27)28-11-17(24)18-2-1-9-29-18/h1-10H,11H2