ethyl 4-[4-[[4-(diethylamino)-2-methyl-phenyl]carbamoyl]-3-oxidanylidene-1H-isoindol-2-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-[[4-(diethylamino)-2-methyl-phenyl]carbamoyl]-3-oxidanylidene-1H-isoindol-2-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[7-[[4-(diethylamino)-2-methyl-phenyl]carbamoyl]-1-oxo-isoindolin-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[4-(diethylamino)-2-methylanilino]-oxomethyl]-3-oxo-1H-isoindol-2-yl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[[4-(diethylamino)-2-methylphenyl]carbamoyl]-3-oxo-1H-isoindol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[7-[[4-(diethylamino)-2-methyl-phenyl]carbamoyl]-1-keto-isoindolin-2-yl]piperidine-1-carboxylic acid ethyl ester Formula: C28H36N4O4 MolecularWeight: 492.60984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)NC(=O)C2=C3C(=CC=C2)CN(C3=O)C4CCN(CC4)C(=O)OCC)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)NC(=O)C2=C3C(=CC=C2)CN(C3=O)C4CCN(CC4)C(=O)OCC)C

InChI

InChI=1S/C28H36N4O4/c1-5-30(6-2)22-11-12-24(19(4)17-22)29-26(33)23-10-8-9-20-18-32(27(34)25(20)23)21-13-15-31(16-14-21)28(35)36-7-3/h8-12,17,21H,5-7,13-16,18H2,1-4H3,(H,29,33)