(3,3-dimethyl-2-oxidanylidene-butyl) 6,7,11,12b-tetrahydroacenaphthyleno[1,2-b]quinoxaline-9-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 6,7,11,12b-tetrahydroacenaphthyleno[1,2-b]quinoxaline-9-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 6,7,11,12b-tetrahydroacenaphthyleno[1,2-b]quinoxaline-9-carboxylate CAS Name: 6,7,11,12b-tetrahydroacenaphthyleno[1,2-b]quinoxaline-9-carboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 6,7,11,12b-tetrahydroacenaphthyleno[1,2-b]quinoxaline-9-carboxylate Traditional Name: 6,7,11,12b-tetrahydroacenaphtho[1,2-b]quinoxaline-9-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C25H24N2O3 MolecularWeight: 400.46966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CCC2=NC3=C(C4=C5C3C=CC=C5C=CC4)NC2=C1

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CCC2=NC3=C(C4=C5C3C=CC=C5C=CC4)NC2=C1

InChI

InChI=1S/C25H24N2O3/c1-25(2,3)20(28)13-30-24(29)15-10-11-18-19(12-15)27-23-17-9-5-7-14-6-4-8-16(21(14)17)22(23)26-18/h4-8,10,12,16,27H,9,11,13H2,1-3H3