2-(4-methylphenyl)-5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-isoindole-1,3-dione

Systemtic Name: 2-(4-methylphenyl)-5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-isoindole-1,3-dione Openeye Name: 5-(4-benzylpiperidine-1-carbonyl)-2-(p-tolyl)isoindoline-1,3-dione CAS Name: 2-(4-methylphenyl)-5-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]isoindole-1,3-dione IUPAC Name: 5-(4-benzylpiperidine-1-carbonyl)-2-(4-methylphenyl)isoindole-1,3-dione Traditional Name: 5-(4-benzylpiperidine-1-carbonyl)-2-(p-tolyl)isoindoline-1,3-quinone Formula: C28H26N2O3 MolecularWeight: 438.51764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H26N2O3/c1-19-7-10-23(11-8-19)30-27(32)24-12-9-22(18-25(24)28(30)33)26(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-12,18,21H,13-17H2,1H3