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

Systemtic Name: ethyl 1-[4-[(2-ethyl-3-oxidanylidene-1H-isoindol-1-yl)amino]phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-[(2-ethyl-3-oxo-isoindolin-1-yl)amino]benzoyl]piperidine-4-carboxylate CAS Name: 1-[[4-[(2-ethyl-3-oxo-1H-isoindol-1-yl)amino]phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[(2-ethyl-3-oxo-1H-isoindol-1-yl)amino]benzoyl]piperidine-4-carboxylate Traditional Name: 1-[4-[(2-ethyl-3-keto-isoindolin-1-yl)amino]benzoyl]isonipecotic acid ethyl ester Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(C2=CC=CC=C2C1=O)NC3=CC=C(C=C3)C(=O)N4CCC(CC4)C(=O)OCC

Isomeric SMILES

CCN1C(C2=CC=CC=C2C1=O)NC3=CC=C(C=C3)C(=O)N4CCC(CC4)C(=O)OCC

InChI

InChI=1S/C25H29N3O4/c1-3-28-22(20-7-5-6-8-21(20)24(28)30)26-19-11-9-17(10-12-19)23(29)27-15-13-18(14-16-27)25(31)32-4-2/h5-12,18,22,26H,3-4,13-16H2,1-2H3