azepan-2-ylidene-[2-(3,4-dichlorophenyl)-2-oxidanylidene-ethyl]-(2-methylphenyl)azanium

Systemtic Name: azepan-2-ylidene-[2-(3,4-dichlorophenyl)-2-oxidanylidene-ethyl]-(2-methylphenyl)azanium Openeye Name: azepan-2-ylidene-[2-(3,4-dichlorophenyl)-2-oxo-ethyl]-(o-tolyl)ammonium CAS Name: 2-azepanylidene-[2-(3,4-dichlorophenyl)-2-oxoethyl]-(2-methylphenyl)ammonium IUPAC Name: azepan-2-ylidene-[2-(3,4-dichlorophenyl)-2-oxoethyl]-(2-methylphenyl)azanium Traditional Name: azepan-2-ylidene-[2-(3,4-dichlorophenyl)-2-keto-ethyl]-(o-tolyl)ammonium Formula: C21H23Cl2N2O+ MolecularWeight: 390.32612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22Cl2N2O/c1-15-7-4-5-8-19(15)25(21-9-3-2-6-12-24-21)14-20(26)16-10-11-17(22)18(23)13-16/h4-5,7-8,10-11,13H,2-3,6,9,12,14H2,1H3/p+1