3-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]-3-phenyl-2H-isoquinoline-1,4-dione

Systemtic Name: 3-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]-3-phenyl-2H-isoquinoline-1,4-dione Openeye Name: 3-(4,4-dimethyl-2,6-dioxo-cyclohexyl)-3-phenyl-2H-isoquinoline-1,4-dione CAS Name: 3-(4,4-dimethyl-2,6-dioxocyclohexyl)-3-phenyl-2H-isoquinoline-1,4-dione IUPAC Name: 3-(4,4-dimethyl-2,6-dioxocyclohexyl)-3-phenyl-2H-isoquinoline-1,4-dione Traditional Name: 3-(2,6-diketo-4,4-dimethyl-cyclohexyl)-3-phenyl-2H-isoquinoline-1,4-quinone Formula: C23H21NO4 MolecularWeight: 375.41714

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C2(C(=O)C3=CC=CC=C3C(=O)N2)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C2(C(=O)C3=CC=CC=C3C(=O)N2)C4=CC=CC=C4)C

InChI

InChI=1S/C23H21NO4/c1-22(2)12-17(25)19(18(26)13-22)23(14-8-4-3-5-9-14)20(27)15-10-6-7-11-16(15)21(28)24-23/h3-11,19H,12-13H2,1-2H3,(H,24,28)