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

Systemtic Name: ethyl 4-[4-[(3-ethoxycarbonylphenyl)carbamoyl]-3-oxidanylidene-1H-isoindol-2-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[7-[(3-ethoxycarbonylphenyl)carbamoyl]-1-oxo-isoindolin-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(3-ethoxycarbonylanilino)-oxomethyl]-3-oxo-1H-isoindol-2-yl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(3-ethoxycarbonylphenyl)carbamoyl]-3-oxo-1H-isoindol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[7-[(3-carbethoxyphenyl)carbamoyl]-1-keto-isoindolin-2-yl]piperidine-1-carboxylic acid ethyl ester Formula: C26H29N3O6 MolecularWeight: 479.52496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29N3O6/c1-3-34-25(32)17-7-5-9-19(15-17)27-23(30)21-10-6-8-18-16-29(24(31)22(18)21)20-11-13-28(14-12-20)26(33)35-4-2/h5-10,15,20H,3-4,11-14,16H2,1-2H3,(H,27,30)