2-(2-methylphenyl)-4,4-bis(2-oxidanylidene-2-piperidin-1-yl-ethyl)isoquinoline-1,3-dione

Systemtic Name: 2-(2-methylphenyl)-4,4-bis(2-oxidanylidene-2-piperidin-1-yl-ethyl)isoquinoline-1,3-dione Openeye Name: 2-(o-tolyl)-4,4-bis[2-oxo-2-(1-piperidyl)ethyl]isoquinoline-1,3-dione CAS Name: 2-(2-methylphenyl)-4,4-bis[2-oxo-2-(1-piperidinyl)ethyl]isoquinoline-1,3-dione IUPAC Name: 2-(2-methylphenyl)-4,4-bis(2-oxo-2-piperidin-1-ylethyl)isoquinoline-1,3-dione Traditional Name: 4,4-bis(2-keto-2-piperidino-ethyl)-2-(o-tolyl)isoquinoline-1,3-quinone Formula: C30H35N3O4 MolecularWeight: 501.6166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3C(C2=O)(CC(=O)N4CCCCC4)CC(=O)N5CCCCC5

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3C(C2=O)(CC(=O)N4CCCCC4)CC(=O)N5CCCCC5

InChI

InChI=1S/C30H35N3O4/c1-22-12-4-7-15-25(22)33-28(36)23-13-5-6-14-24(23)30(29(33)37,20-26(34)31-16-8-2-9-17-31)21-27(35)32-18-10-3-11-19-32/h4-7,12-15H,2-3,8-11,16-21H2,1H3