(3-methylphenyl)-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]-piperidin-2-ylidene-azanium

Systemtic Name: (3-methylphenyl)-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]-piperidin-2-ylidene-azanium Openeye Name: m-tolyl-[2-oxo-2-(p-tolyl)ethyl]-(2-piperidylidene)ammonium CAS Name: (3-methylphenyl)-[2-(4-methylphenyl)-2-oxoethyl]-(2-piperidinylidene)ammonium IUPAC Name: (3-methylphenyl)-[2-(4-methylphenyl)-2-oxoethyl]-piperidin-2-ylideneazanium Traditional Name: [2-keto-2-(p-tolyl)ethyl]-(m-tolyl)-(2-piperidylidene)ammonium Formula: C21H25N2O+ MolecularWeight: 321.436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C[N+](=C2CCCCN2)C3=CC=CC(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C[N+](=C2CCCCN2)C3=CC=CC(=C3)C

InChI

InChI=1S/C21H24N2O/c1-16-9-11-18(12-10-16)20(24)15-23(21-8-3-4-13-22-21)19-7-5-6-17(2)14-19/h5-7,9-12,14H,3-4,8,13,15H2,1-2H3/p+1