azepan-2-ylidene-(4-methylphenyl)-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]azanium

Systemtic Name: azepan-2-ylidene-(4-methylphenyl)-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]azanium Openeye Name: azepan-2-ylidene-[2-oxo-2-(4-phenylphenyl)ethyl]-(p-tolyl)ammonium CAS Name: 2-azepanylidene-(4-methylphenyl)-[2-oxo-2-(4-phenylphenyl)ethyl]ammonium IUPAC Name: azepan-2-ylidene-(4-methylphenyl)-[2-oxo-2-(4-phenylphenyl)ethyl]azanium Traditional Name: azepan-2-ylidene-[2-keto-2-(4-phenylphenyl)ethyl]-(p-tolyl)ammonium Formula: C27H29N2O+ MolecularWeight: 397.53196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[N+](=C2CCCCCN2)CC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)[N+](=C2CCCCCN2)CC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H28N2O/c1-21-11-17-25(18-12-21)29(27-10-6-3-7-19-28-27)20-26(30)24-15-13-23(14-16-24)22-8-4-2-5-9-22/h2,4-5,8-9,11-18H,3,6-7,10,19-20H2,1H3/p+1