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

Systemtic Name: (5,5-dimethyl-3-oxidanylidene-2-pentanoyl-cyclohexylidene)-(2-methoxyphenyl)azanium Openeye Name: (5,5-dimethyl-3-oxo-2-pentanoyl-cyclohexylidene)-(2-methoxyphenyl)ammonium CAS Name: [5,5-dimethyl-3-oxo-2-(1-oxopentyl)cyclohexylidene]-(2-methoxyphenyl)ammonium IUPAC Name: (5,5-dimethyl-3-oxo-2-pentanoylcyclohexylidene)-(2-methoxyphenyl)azanium Traditional Name: (3-keto-5,5-dimethyl-2-valeryl-cyclohexylidene)-(2-methoxyphenyl)ammonium Formula: C20H28NO3+ MolecularWeight: 330.44122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1C(=[NH+]C2=CC=CC=C2OC)CC(CC1=O)(C)C

Isomeric SMILES

CCCCC(=O)C1C(=[NH+]C2=CC=CC=C2OC)CC(CC1=O)(C)C

InChI

InChI=1S/C20H27NO3/c1-5-6-10-16(22)19-15(12-20(2,3)13-17(19)23)21-14-9-7-8-11-18(14)24-4/h7-9,11,19H,5-6,10,12-13H2,1-4H3/p+1