1-(6,6-dimethyl-5-oxidanylidene-1-phenyl-heptan-4-yl)-3-(2,3-dimethylphenyl)quinazoline-2,4-dione

Systemtic Name: 1-(6,6-dimethyl-5-oxidanylidene-1-phenyl-heptan-4-yl)-3-(2,3-dimethylphenyl)quinazoline-2,4-dione Openeye Name: 1-[3,3-dimethyl-2-oxo-1-(3-phenylpropyl)butyl]-3-(2,3-dimethylphenyl)quinazoline-2,4-dione CAS Name: 1-(6,6-dimethyl-5-oxo-1-phenylheptan-4-yl)-3-(2,3-dimethylphenyl)quinazoline-2,4-dione IUPAC Name: 1-(6,6-dimethyl-5-oxo-1-phenylheptan-4-yl)-3-(2,3-dimethylphenyl)quinazoline-2,4-dione Traditional Name: 3-(2,3-dimethylphenyl)-1-[2-keto-3,3-dimethyl-1-(3-phenylpropyl)butyl]quinazoline-2,4-quinone Formula: C31H34N2O3 MolecularWeight: 482.61326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=O)C3=CC=CC=C3N(C2=O)C(CCCC4=CC=CC=C4)C(=O)C(C)(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)C3=CC=CC=C3N(C2=O)C(CCCC4=CC=CC=C4)C(=O)C(C)(C)C)C

InChI

InChI=1S/C31H34N2O3/c1-21-13-11-19-25(22(21)2)33-29(35)24-17-9-10-18-26(24)32(30(33)36)27(28(34)31(3,4)5)20-12-16-23-14-7-6-8-15-23/h6-11,13-15,17-19,27H,12,16,20H2,1-5H3