2-[bis(4-hydroxyphenyl)methyl]-N-[1-(phenylmethyl)piperidin-1-ium-1-yl]benzamide

Systemtic Name: 2-[bis(4-hydroxyphenyl)methyl]-N-[1-(phenylmethyl)piperidin-1-ium-1-yl]benzamide Openeye Name: N-(1-benzylpiperidin-1-ium-1-yl)-2-[bis(4-hydroxyphenyl)methyl]benzamide CAS Name: 2-[bis(4-hydroxyphenyl)methyl]-N-[1-(phenylmethyl)-1-piperidin-1-iumyl]benzamide IUPAC Name: N-(1-benzylpiperidin-1-ium-1-yl)-2-[bis(4-hydroxyphenyl)methyl]benzamide Traditional Name: N-(1-benzylpiperidin-1-ium-1-yl)-2-[bis(4-hydroxyphenyl)methyl]benzamide Formula: C32H33N2O3+ MolecularWeight: 493.61602

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3C(C4=CC=C(C=C4)O)C5=CC=C(C=C5)O

Isomeric SMILES

C1CC[N+](CC1)(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3C(C4=CC=C(C=C4)O)C5=CC=C(C=C5)O

InChI

InChI=1S/C32H32N2O3/c35-27-17-13-25(14-18-27)31(26-15-19-28(36)20-16-26)29-11-5-6-12-30(29)32(37)33-34(21-7-2-8-22-34)23-24-9-3-1-4-10-24/h1,3-6,9-20,31H,2,7-8,21-23H2,(H2-,33,35,36,37)/p+1