2-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]-N-(2-ethyl-6-methyl-phenyl)ethanamide

Systemtic Name: 2-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]-N-(2-ethyl-6-methyl-phenyl)ethanamide Openeye Name: 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)-N-(2-ethyl-6-methyl-phenyl)acetamide CAS Name: 2-[4-(diphenylmethyl)-1-piperazine-1,4-diiumyl]-N-(2-ethyl-6-methylphenyl)acetamide IUPAC Name: 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)-N-(2-ethyl-6-methylphenyl)acetamide Traditional Name: 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)-N-(2-ethyl-6-methyl-phenyl)acetamide Formula: C28H35N3O+2 MolecularWeight: 429.597

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C[NH+]2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C[NH+]2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C28H33N3O/c1-3-23-16-10-11-22(2)27(23)29-26(32)21-30-17-19-31(20-18-30)28(24-12-6-4-7-13-24)25-14-8-5-9-15-25/h4-16,28H,3,17-21H2,1-2H3,(H,29,32)/p+2