N-[2-(4-methoxyphenyl)ethyl]-4-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]benzamide

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-4-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]benzamide Openeye Name: 4-[(4-benzylpiperidin-1-ium-1-yl)methyl]-N-[2-(4-methoxyphenyl)ethyl]benzamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-4-[[4-(phenylmethyl)-1-piperidin-1-iumyl]methyl]benzamide IUPAC Name: 4-[(4-benzylpiperidin-1-ium-1-yl)methyl]-N-[2-(4-methoxyphenyl)ethyl]benzamide Traditional Name: 4-[(4-benzylpiperidin-1-ium-1-yl)methyl]-N-[2-(4-methoxyphenyl)ethyl]benzamide Formula: C29H35N2O2+ MolecularWeight: 443.6004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C2=CC=C(C=C2)C[NH+]3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)C2=CC=C(C=C2)C[NH+]3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C29H34N2O2/c1-33-28-13-9-23(10-14-28)15-18-30-29(32)27-11-7-26(8-12-27)22-31-19-16-25(17-20-31)21-24-5-3-2-4-6-24/h2-14,25H,15-22H2,1H3,(H,30,32)/p+1