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

Systemtic Name: ethyl 4-[4-[(4-ethoxyphenyl)carbamoyl]-3-oxidanylidene-1H-isoindol-2-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[7-[(4-ethoxyphenyl)carbamoyl]-1-oxo-isoindolin-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(4-ethoxyanilino)-oxomethyl]-3-oxo-1H-isoindol-2-yl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(4-ethoxyphenyl)carbamoyl]-3-oxo-1H-isoindol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[1-keto-7-(p-phenetylcarbamoyl)isoindolin-2-yl]piperidine-1-carboxylic acid ethyl ester Formula: C25H29N3O5 MolecularWeight: 451.51486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=C3C(=CC=C2)CN(C3=O)C4CCN(CC4)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=C3C(=CC=C2)CN(C3=O)C4CCN(CC4)C(=O)OCC

InChI

InChI=1S/C25H29N3O5/c1-3-32-20-10-8-18(9-11-20)26-23(29)21-7-5-6-17-16-28(24(30)22(17)21)19-12-14-27(15-13-19)25(31)33-4-2/h5-11,19H,3-4,12-16H2,1-2H3,(H,26,29)