(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl) 2,3-diphenylquinoxaline-6-carboxylate

Systemtic Name: (5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl) 2,3-diphenylquinoxaline-6-carboxylate Openeye Name: (5,5-dimethyl-3-oxo-cyclohexen-1-yl) 2,3-diphenylquinoxaline-6-carboxylate CAS Name: 2,3-diphenyl-6-quinoxalinecarboxylic acid (5,5-dimethyl-3-oxo-1-cyclohexenyl) ester IUPAC Name: (5,5-dimethyl-3-oxocyclohexen-1-yl) 2,3-diphenylquinoxaline-6-carboxylate Traditional Name: 2,3-diphenylquinoxaline-6-carboxylic acid (3-keto-5,5-dimethyl-cyclohexen-1-yl) ester Formula: C29H24N2O3 MolecularWeight: 448.51246

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)OC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)OC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C29H24N2O3/c1-29(2)17-22(32)16-23(18-29)34-28(33)21-13-14-24-25(15-21)31-27(20-11-7-4-8-12-20)26(30-24)19-9-5-3-6-10-19/h3-16H,17-18H2,1-2H3