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

Systemtic Name: 2-(2-methylphenyl)-4,4-bis(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)isoquinoline-1,3-dione Openeye Name: 2-(o-tolyl)-4,4-bis(2-oxo-2-pyrrolidin-1-yl-ethyl)isoquinoline-1,3-dione CAS Name: 2-(2-methylphenyl)-4,4-bis[2-oxo-2-(1-pyrrolidinyl)ethyl]isoquinoline-1,3-dione IUPAC Name: 2-(2-methylphenyl)-4,4-bis(2-oxo-2-pyrrolidin-1-ylethyl)isoquinoline-1,3-dione Traditional Name: 4,4-bis(2-keto-2-pyrrolidino-ethyl)-2-(o-tolyl)isoquinoline-1,3-quinone Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3C(C2=O)(CC(=O)N4CCCC4)CC(=O)N5CCCC5

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3C(C2=O)(CC(=O)N4CCCC4)CC(=O)N5CCCC5

InChI

InChI=1S/C28H31N3O4/c1-20-10-2-5-13-23(20)31-26(34)21-11-3-4-12-22(21)28(27(31)35,18-24(32)29-14-6-7-15-29)19-25(33)30-16-8-9-17-30/h2-5,10-13H,6-9,14-19H2,1H3