1-(4-methoxyphenyl)-2,5-dimethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyrrole-3-carboxamide

Systemtic Name: 1-(4-methoxyphenyl)-2,5-dimethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyrrole-3-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-1-(4-methoxyphenyl)-2,5-dimethyl-pyrrole-3-carboxamide CAS Name: 1-(4-methoxyphenyl)-2,5-dimethyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-pyrrolecarboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-1-(4-methoxyphenyl)-2,5-dimethylpyrrole-3-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-1-(4-methoxyphenyl)-2,5-dimethyl-pyrrole-3-carboxamide Formula: C26H32N3O2+ MolecularWeight: 418.55118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H31N3O2/c1-19-17-25(20(2)29(19)23-9-11-24(31-3)12-10-23)26(30)27-22-13-15-28(16-14-22)18-21-7-5-4-6-8-21/h4-12,17,22H,13-16,18H2,1-3H3,(H,27,30)/p+1