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

Systemtic Name: azepan-2-ylidene-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]-phenyl-azanium Openeye Name: azepan-2-ylidene-[2-oxo-2-(p-tolyl)ethyl]-phenyl-ammonium CAS Name: 2-azepanylidene-[2-(4-methylphenyl)-2-oxoethyl]-phenylammonium IUPAC Name: azepan-2-ylidene-[2-(4-methylphenyl)-2-oxoethyl]-phenylazanium Traditional Name: azepan-2-ylidene-[2-keto-2-(p-tolyl)ethyl]-phenyl-ammonium Formula: C21H25N2O+ MolecularWeight: 321.436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O/c1-17-11-13-18(14-12-17)20(24)16-23(19-8-4-2-5-9-19)21-10-6-3-7-15-22-21/h2,4-5,8-9,11-14H,3,6-7,10,15-16H2,1H3/p+1