(3,3-dimethyl-2-oxidanylidene-butyl) acenaphthyleno[1,2-b]quinoxaline-9-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) acenaphthyleno[1,2-b]quinoxaline-9-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) acenaphthyleno[1,2-b]quinoxaline-9-carboxylate CAS Name: 9-acenaphthyleno[1,2-b]quinoxalinecarboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) acenaphthyleno[1,2-b]quinoxaline-9-carboxylate Traditional Name: acenaphtho[1,2-b]quinoxaline-9-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C25H20N2O3 MolecularWeight: 396.4379

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC2=C(C=C1)N=C3C4=CC=CC5=C4C(=CC=C5)C3=N2

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC2=C(C=C1)N=C3C4=CC=CC5=C4C(=CC=C5)C3=N2

InChI

InChI=1S/C25H20N2O3/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/h4-12H,13H2,1-3H3