(phenylmethyl) 1,3-bis(oxidanylidene)-5-piperidin-1-yl-isoindole-2-carboxylate

Systemtic Name: (phenylmethyl) 1,3-bis(oxidanylidene)-5-piperidin-1-yl-isoindole-2-carboxylate Openeye Name: benzyl 1,3-dioxo-5-(1-piperidyl)isoindoline-2-carboxylate CAS Name: 1,3-dioxo-5-(1-piperidinyl)-2-isoindolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1,3-dioxo-5-piperidin-1-ylisoindole-2-carboxylate Traditional Name: 1,3-diketo-5-piperidino-isoindoline-2-carboxylic acid benzyl ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC3=C(C=C2)C(=O)N(C3=O)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=CC3=C(C=C2)C(=O)N(C3=O)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C21H20N2O4/c24-19-17-10-9-16(22-11-5-2-6-12-22)13-18(17)20(25)23(19)21(26)27-14-15-7-3-1-4-8-15/h1,3-4,7-10,13H,2,5-6,11-12,14H2