1-[(4-hydroxyphenyl)methyl]-N-[4-(3-methylphenyl)phenyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(4-hydroxyphenyl)methyl]-N-[4-(3-methylphenyl)phenyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-hydroxyphenyl)methyl]-N-[4-(m-tolyl)phenyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-hydroxyphenyl)methyl]-N-[4-(3-methylphenyl)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-hydroxyphenyl)methyl]-N-[4-(3-methylphenyl)phenyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-hydroxybenzyl)-N-[4-(m-tolyl)phenyl]piperidin-1-ium-4-carboxamide Formula: C26H29N2O2+ MolecularWeight: 401.52066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC=C(C=C2)NC(=O)C3CC[NH+](CC3)CC4=CC=C(C=C4)O

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC=C(C=C2)NC(=O)C3CC[NH+](CC3)CC4=CC=C(C=C4)O

InChI

InChI=1S/C26H28N2O2/c1-19-3-2-4-23(17-19)21-7-9-24(10-8-21)27-26(30)22-13-15-28(16-14-22)18-20-5-11-25(29)12-6-20/h2-12,17,22,29H,13-16,18H2,1H3,(H,27,30)/p+1