azepan-2-ylidene-(3-chlorophenyl)-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: azepan-2-ylidene-(3-chlorophenyl)-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]azanium Openeye Name: azepan-2-ylidene-(3-chlorophenyl)-[2-(4-methoxyphenyl)-2-oxo-ethyl]ammonium CAS Name: 2-azepanylidene-(3-chlorophenyl)-[2-(4-methoxyphenyl)-2-oxoethyl]ammonium IUPAC Name: azepan-2-ylidene-(3-chlorophenyl)-[2-(4-methoxyphenyl)-2-oxoethyl]azanium Traditional Name: azepan-2-ylidene-(3-chlorophenyl)-[2-keto-2-(4-methoxyphenyl)ethyl]ammonium Formula: C21H24ClN2O2+ MolecularWeight: 371.88046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C[N+](=C2CCCCCN2)C3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C[N+](=C2CCCCCN2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H23ClN2O2/c1-26-19-11-9-16(10-12-19)20(25)15-24(18-7-5-6-17(22)14-18)21-8-3-2-4-13-23-21/h5-7,9-12,14H,2-4,8,13,15H2,1H3/p+1