3-[[4-(4-fluorophenyl)carbonyl-1H-pyrrol-2-yl]carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[4-(4-fluorophenyl)carbonyl-1H-pyrrol-2-yl]carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[4-(4-fluorobenzoyl)-1H-pyrrole-2-carbonyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[4-[(4-fluorophenyl)-oxomethyl]-1H-pyrrol-2-yl]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[4-(4-fluorobenzoyl)-1H-pyrrole-2-carbonyl]amino]propyl-dimethylazanium Traditional Name: 3-[[4-(4-fluorobenzoyl)-1H-pyrrole-2-carbonyl]amino]propyl-dimethyl-ammonium Formula: C17H21FN3O2+ MolecularWeight: 318.365943

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)C1=CC(=CN1)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

C[NH+](C)CCCNC(=O)C1=CC(=CN1)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H20FN3O2/c1-21(2)9-3-8-19-17(23)15-10-13(11-20-15)16(22)12-4-6-14(18)7-5-12/h4-7,10-11,20H,3,8-9H2,1-2H3,(H,19,23)/p+1