azepan-2-ylidene-(4-ethylphenyl)-[2-(2-fluoranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: azepan-2-ylidene-(4-ethylphenyl)-[2-(2-fluoranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]azanium Openeye Name: azepan-2-ylidene-(4-ethylphenyl)-[2-(2-fluoro-4-methoxy-phenyl)-2-oxo-ethyl]ammonium CAS Name: 2-azepanylidene-(4-ethylphenyl)-[2-(2-fluoro-4-methoxyphenyl)-2-oxoethyl]ammonium IUPAC Name: azepan-2-ylidene-(4-ethylphenyl)-[2-(2-fluoro-4-methoxyphenyl)-2-oxoethyl]azanium Traditional Name: azepan-2-ylidene-(4-ethylphenyl)-[2-(2-fluoro-4-methoxy-phenyl)-2-keto-ethyl]ammonium Formula: C23H28FN2O2+ MolecularWeight: 383.479023

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)[N+](=C2CCCCCN2)CC(=O)C3=C(C=C(C=C3)OC)F

Isomeric SMILES

CCC1=CC=C(C=C1)[N+](=C2CCCCCN2)CC(=O)C3=C(C=C(C=C3)OC)F

InChI

InChI=1S/C23H27FN2O2/c1-3-17-8-10-18(11-9-17)26(23-7-5-4-6-14-25-23)16-22(27)20-13-12-19(28-2)15-21(20)24/h8-13,15H,3-7,14,16H2,1-2H3/p+1