(5,5-dimethyl-3-oxidanylidene-2-pentanoyl-cyclohexylidene)-(4-nitrophenyl)azanium

Systemtic Name: (5,5-dimethyl-3-oxidanylidene-2-pentanoyl-cyclohexylidene)-(4-nitrophenyl)azanium Openeye Name: (5,5-dimethyl-3-oxo-2-pentanoyl-cyclohexylidene)-(4-nitrophenyl)ammonium CAS Name: [5,5-dimethyl-3-oxo-2-(1-oxopentyl)cyclohexylidene]-(4-nitrophenyl)ammonium IUPAC Name: (5,5-dimethyl-3-oxo-2-pentanoylcyclohexylidene)-(4-nitrophenyl)azanium Traditional Name: (3-keto-5,5-dimethyl-2-valeryl-cyclohexylidene)-(4-nitrophenyl)ammonium Formula: C19H25N2O4+ MolecularWeight: 345.4128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1C(=[NH+]C2=CC=C(C=C2)[N+](=O)[O-])CC(CC1=O)(C)C

Isomeric SMILES

CCCCC(=O)C1C(=[NH+]C2=CC=C(C=C2)[N+](=O)[O-])CC(CC1=O)(C)C

InChI

InChI=1S/C19H24N2O4/c1-4-5-6-16(22)18-15(11-19(2,3)12-17(18)23)20-13-7-9-14(10-8-13)21(24)25/h7-10,18H,4-6,11-12H2,1-3H3/p+1