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

Systemtic Name: azepan-2-ylidene-(3-chlorophenyl)-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]azanium Openeye Name: azepan-2-ylidene-(3-chlorophenyl)-[2-(4-ethoxyphenyl)-2-oxo-ethyl]ammonium CAS Name: 2-azepanylidene-(3-chlorophenyl)-[2-(4-ethoxyphenyl)-2-oxoethyl]ammonium IUPAC Name: azepan-2-ylidene-(3-chlorophenyl)-[2-(4-ethoxyphenyl)-2-oxoethyl]azanium Traditional Name: azepan-2-ylidene-(3-chlorophenyl)-(2-keto-2-p-phenetyl-ethyl)ammonium Formula: C22H26ClN2O2+ MolecularWeight: 385.90704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C[N+](=C2CCCCCN2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)C[N+](=C2CCCCCN2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H25ClN2O2/c1-2-27-20-12-10-17(11-13-20)21(26)16-25(19-8-6-7-18(23)15-19)22-9-4-3-5-14-24-22/h6-8,10-13,15H,2-5,9,14,16H2,1H3/p+1