[2-(4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethyl]-[(4-fluorophenyl)methyl]-methyl-azanium

Systemtic Name: [2-(4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethyl]-[(4-fluorophenyl)methyl]-methyl-azanium Openeye Name: [2-(4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxo-ethyl]-[(4-fluorophenyl)methyl]-methyl-ammonium CAS Name: [2-(4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]-[(4-fluorophenyl)methyl]-methylammonium IUPAC Name: [2-(4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]-[(4-fluorophenyl)methyl]-methylazanium Traditional Name: [2-(4-carbethoxy-3,5-dimethyl-1H-pyrrol-2-yl)-2-keto-ethyl]-(4-fluorobenzyl)-methyl-ammonium Formula: C19H24FN2O3+ MolecularWeight: 347.403863

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)C[NH+](C)CC2=CC=C(C=C2)F)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)C[NH+](C)CC2=CC=C(C=C2)F)C

InChI

InChI=1S/C19H23FN2O3/c1-5-25-19(24)17-12(2)18(21-13(17)3)16(23)11-22(4)10-14-6-8-15(20)9-7-14/h6-9,21H,5,10-11H2,1-4H3/p+1