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

Systemtic Name: azepan-2-ylidene-(3-chlorophenyl)-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]azanium Openeye Name: azepan-2-ylidene-(3-chlorophenyl)-[2-(4-fluorophenyl)-2-oxo-ethyl]ammonium CAS Name: 2-azepanylidene-(3-chlorophenyl)-[2-(4-fluorophenyl)-2-oxoethyl]ammonium IUPAC Name: azepan-2-ylidene-(3-chlorophenyl)-[2-(4-fluorophenyl)-2-oxoethyl]azanium Traditional Name: azepan-2-ylidene-(3-chlorophenyl)-[2-(4-fluorophenyl)-2-keto-ethyl]ammonium Formula: C20H21ClFN2O+ MolecularWeight: 359.844943

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=[N+](CC(=O)C2=CC=C(C=C2)F)C3=CC(=CC=C3)Cl)NCC1

Isomeric SMILES

C1CCC(=[N+](CC(=O)C2=CC=C(C=C2)F)C3=CC(=CC=C3)Cl)NCC1

InChI

InChI=1S/C20H20ClFN2O/c21-16-5-4-6-18(13-16)24(20-7-2-1-3-12-23-20)14-19(25)15-8-10-17(22)11-9-15/h4-6,8-11,13H,1-3,7,12,14H2/p+1