N-(diphenylmethyl)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-methyl-ethanamide

Systemtic Name: N-(diphenylmethyl)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-methyl-ethanamide Openeye Name: N-benzhydryl-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-methyl-acetamide CAS Name: N-(diphenylmethyl)-2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]-N-methylacetamide IUPAC Name: N-benzhydryl-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-methylacetamide Traditional Name: N-benzhydryl-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-methyl-acetamide Formula: C26H30N3O2+ MolecularWeight: 416.5353

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)C[NH+]3CCN(CC3)C4=CC=C(C=C4)O

Isomeric SMILES

CN(C(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)C[NH+]3CCN(CC3)C4=CC=C(C=C4)O

InChI

InChI=1S/C26H29N3O2/c1-27(26(21-8-4-2-5-9-21)22-10-6-3-7-11-22)25(31)20-28-16-18-29(19-17-28)23-12-14-24(30)15-13-23/h2-15,26,30H,16-20H2,1H3/p+1