(3,3-dimethyl-2-oxidanylidene-butyl) 2,3-diphenylquinoxaline-6-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2,3-diphenylquinoxaline-6-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2,3-diphenylquinoxaline-6-carboxylate CAS Name: 2,3-diphenyl-6-quinoxalinecarboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2,3-diphenylquinoxaline-6-carboxylate Traditional Name: 2,3-diphenylquinoxaline-6-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C27H24N2O3 MolecularWeight: 424.49106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC2=C(C=C1)N=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC2=C(C=C1)N=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H24N2O3/c1-27(2,3)23(30)17-32-26(31)20-14-15-21-22(16-20)29-25(19-12-8-5-9-13-19)24(28-21)18-10-6-4-7-11-18/h4-16H,17H2,1-3H3