2-butanoyl-5,5-dimethyl-3-(4-nitrophenyl)imino-cyclohexan-1-one

Systemtic Name: 2-butanoyl-5,5-dimethyl-3-(4-nitrophenyl)imino-cyclohexan-1-one Openeye Name: 2-butanoyl-5,5-dimethyl-3-(4-nitrophenyl)imino-cyclohexanone CAS Name: 5,5-dimethyl-3-(4-nitrophenyl)imino-2-(1-oxobutyl)-1-cyclohexanone IUPAC Name: 2-butanoyl-5,5-dimethyl-3-(4-nitrophenyl)iminocyclohexan-1-one Traditional Name: 2-butyryl-5,5-dimethyl-3-(4-nitrophenyl)imino-cyclohexanone Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1C(=NC2=CC=C(C=C2)[N+](=O)[O-])CC(CC1=O)(C)C

Isomeric SMILES

CCCC(=O)C1C(=NC2=CC=C(C=C2)[N+](=O)[O-])CC(CC1=O)(C)C

InChI

InChI=1S/C18H22N2O4/c1-4-5-15(21)17-14(10-18(2,3)11-16(17)22)19-12-6-8-13(9-7-12)20(23)24/h6-9,17H,4-5,10-11H2,1-3H3