(1-oxidanylidene-1-phenyl-butan-2-yl) 2-(2-chlorophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (1-oxidanylidene-1-phenyl-butan-2-yl) 2-(2-chlorophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 1-benzoylpropyl 2-(2-chlorophenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(2-chlorophenyl)-1,3-dioxo-5-isoindolecarboxylic acid (1-oxo-1-phenylbutan-2-yl) ester IUPAC Name: (1-oxo-1-phenylbutan-2-yl) 2-(2-chlorophenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(2-chlorophenyl)-1,3-diketo-isoindoline-5-carboxylic acid 1-benzoylpropyl ester Formula: C25H18ClNO5 MolecularWeight: 447.86712

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC=C4Cl

Isomeric SMILES

CCC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C25H18ClNO5/c1-2-21(22(28)15-8-4-3-5-9-15)32-25(31)16-12-13-17-18(14-16)24(30)27(23(17)29)20-11-7-6-10-19(20)26/h3-14,21H,2H2,1H3