ethyl 4-[4-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-3-oxidanylidene-1H-isoindol-2-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-3-oxidanylidene-1H-isoindol-2-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[7-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-oxo-isoindolin-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-3-oxo-1H-isoindol-2-yl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-oxo-1H-isoindol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[7-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-keto-isoindolin-2-yl]piperidine-1-carboxylic acid ethyl ester Formula: C27H31ClN4O4 MolecularWeight: 511.01244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2CC3=CC=CC(=C3C2=O)C(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2CC3=CC=CC(=C3C2=O)C(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C27H31ClN4O4/c1-2-36-27(35)31-11-9-21(10-12-31)32-18-19-5-3-8-23(24(19)26(32)34)25(33)30-15-13-29(14-16-30)22-7-4-6-20(28)17-22/h3-8,17,21H,2,9-16,18H2,1H3