[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 1,3-bis(oxidanylidene)-2-phenethyl-isoindole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 1,3-bis(oxidanylidene)-2-phenethyl-isoindole-5-carboxylate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1,3-dioxo-2-phenethyl-isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-phenethyl-5-isoindolecarboxylic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1,3-dioxo-2-phenethylisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-phenethyl-isoindoline-5-carboxylic acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C23H18N2O5 MolecularWeight: 402.39942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C4=CC=CN4

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C4=CC=CN4

InChI

InChI=1S/C23H18N2O5/c26-20(19-7-4-11-24-19)14-30-23(29)16-8-9-17-18(13-16)22(28)25(21(17)27)12-10-15-5-2-1-3-6-15/h1-9,11,13,24H,10,12,14H2