ethyl 4-[[3-oxidanylidene-2-(pyridin-3-ylmethyl)-1H-isoindol-4-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[3-oxidanylidene-2-(pyridin-3-ylmethyl)-1H-isoindol-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[3-oxo-2-(3-pyridylmethyl)isoindoline-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[oxo-[3-oxo-2-(3-pyridinylmethyl)-1H-isoindol-4-yl]methyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-oxo-2-(pyridin-3-ylmethyl)-1H-isoindole-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[3-keto-2-(3-pyridylmethyl)isoindoline-4-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=C3C(=CC=C2)CN(C3=O)CC4=CN=CC=C4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=C3C(=CC=C2)CN(C3=O)CC4=CN=CC=C4

InChI

InChI=1S/C23H26N4O4/c1-2-31-23(30)26-11-8-18(9-12-26)25-21(28)19-7-3-6-17-15-27(22(29)20(17)19)14-16-5-4-10-24-13-16/h3-7,10,13,18H,2,8-9,11-12,14-15H2,1H3,(H,25,28)