ethyl 1-[4-[[2-(2-methylpropyl)-3-oxidanylidene-1H-isoindol-1-yl]amino]phenyl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[4-[[2-(2-methylpropyl)-3-oxidanylidene-1H-isoindol-1-yl]amino]phenyl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[4-[(2-isobutyl-3-oxo-isoindolin-1-yl)amino]benzoyl]piperidine-3-carboxylate CAS Name: 1-[[4-[[2-(2-methylpropyl)-3-oxo-1H-isoindol-1-yl]amino]phenyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[[2-(2-methylpropyl)-3-oxo-1H-isoindol-1-yl]amino]benzoyl]piperidine-3-carboxylate Traditional Name: 1-[4-[(2-isobutyl-3-keto-isoindolin-1-yl)amino]benzoyl]nipecotic acid ethyl ester Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)NC3C4=CC=CC=C4C(=O)N3CC(C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)NC3C4=CC=CC=C4C(=O)N3CC(C)C

InChI

InChI=1S/C27H33N3O4/c1-4-34-27(33)20-8-7-15-29(17-20)25(31)19-11-13-21(14-12-19)28-24-22-9-5-6-10-23(22)26(32)30(24)16-18(2)3/h5-6,9-14,18,20,24,28H,4,7-8,15-17H2,1-3H3