5-(4-fluorophenyl)-2-methyl-1-(4-methylphenyl)-N-(2-piperidin-1-ium-1-ylethyl)pyrrole-3-carboxamide

Systemtic Name: 5-(4-fluorophenyl)-2-methyl-1-(4-methylphenyl)-N-(2-piperidin-1-ium-1-ylethyl)pyrrole-3-carboxamide Openeye Name: 5-(4-fluorophenyl)-2-methyl-N-(2-piperidin-1-ium-1-ylethyl)-1-(p-tolyl)pyrrole-3-carboxamide CAS Name: 5-(4-fluorophenyl)-2-methyl-1-(4-methylphenyl)-N-[2-(1-piperidin-1-iumyl)ethyl]-3-pyrrolecarboxamide IUPAC Name: 5-(4-fluorophenyl)-2-methyl-1-(4-methylphenyl)-N-(2-piperidin-1-ium-1-ylethyl)pyrrole-3-carboxamide Traditional Name: 5-(4-fluorophenyl)-2-methyl-N-(2-piperidin-1-ium-1-ylethyl)-1-(p-tolyl)pyrrole-3-carboxamide Formula: C26H31FN3O+ MolecularWeight: 420.542243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=C2C3=CC=C(C=C3)F)C(=O)NCC[NH+]4CCCCC4)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=C2C3=CC=C(C=C3)F)C(=O)NCC[NH+]4CCCCC4)C

InChI

InChI=1S/C26H30FN3O/c1-19-6-12-23(13-7-19)30-20(2)24(18-25(30)21-8-10-22(27)11-9-21)26(31)28-14-17-29-15-4-3-5-16-29/h6-13,18H,3-5,14-17H2,1-2H3,(H,28,31)/p+1