2-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]-N-[(3-methoxyphenyl)methyl]ethanamide

Systemtic Name: 2-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]-N-[(3-methoxyphenyl)methyl]ethanamide Openeye Name: 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide CAS Name: 2-[4-(diphenylmethyl)-1-piperazine-1,4-diiumyl]-N-[(3-methoxyphenyl)methyl]acetamide IUPAC Name: 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide Traditional Name: 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)-N-m-anisyl-acetamide Formula: C27H33N3O2+2 MolecularWeight: 431.56982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)C[NH+]2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)C[NH+]2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O2/c1-32-25-14-8-9-22(19-25)20-28-26(31)21-29-15-17-30(18-16-29)27(23-10-4-2-5-11-23)24-12-6-3-7-13-24/h2-14,19,27H,15-18,20-21H2,1H3,(H,28,31)/p+2