2-methyl-1-(4-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenyl-pyrrole-3-carboxamide

Systemtic Name: 2-methyl-1-(4-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenyl-pyrrole-3-carboxamide Openeye Name: 2-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenyl-1-(p-tolyl)pyrrole-3-carboxamide CAS Name: 2-methyl-1-(4-methylphenyl)-N-[3-(4-morpholin-4-iumyl)propyl]-5-phenyl-3-pyrrolecarboxamide IUPAC Name: 2-methyl-1-(4-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenylpyrrole-3-carboxamide Traditional Name: 2-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenyl-1-(p-tolyl)pyrrole-3-carboxamide Formula: C26H32N3O2+ MolecularWeight: 418.55118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=C2C3=CC=CC=C3)C(=O)NCCC[NH+]4CCOCC4)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=C2C3=CC=CC=C3)C(=O)NCCC[NH+]4CCOCC4)C

InChI

InChI=1S/C26H31N3O2/c1-20-9-11-23(12-10-20)29-21(2)24(19-25(29)22-7-4-3-5-8-22)26(30)27-13-6-14-28-15-17-31-18-16-28/h3-5,7-12,19H,6,13-18H2,1-2H3,(H,27,30)/p+1