2-[[5-(4-fluorophenyl)-2-methyl-1-phenyl-pyrrol-3-yl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[5-(4-fluorophenyl)-2-methyl-1-phenyl-pyrrol-3-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[5-(4-fluorophenyl)-2-methyl-1-phenyl-pyrrole-3-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[5-(4-fluorophenyl)-2-methyl-1-phenyl-3-pyrrolyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[5-(4-fluorophenyl)-2-methyl-1-phenylpyrrole-3-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[5-(4-fluorophenyl)-2-methyl-1-phenyl-pyrrole-3-carbonyl]amino]ethyl-dimethyl-ammonium Formula: C22H25FN3O+ MolecularWeight: 366.451803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)F)C(=O)NCC[NH+](C)C

Isomeric SMILES

CC1=C(C=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)F)C(=O)NCC[NH+](C)C

InChI

InChI=1S/C22H24FN3O/c1-16-20(22(27)24-13-14-25(2)3)15-21(17-9-11-18(23)12-10-17)26(16)19-7-5-4-6-8-19/h4-12,15H,13-14H2,1-3H3,(H,24,27)/p+1