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

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-ium-1-yl]-N-(furan-2-ylmethyl)-N-methyl-ethanamide Openeye Name: 2-(4-benzhydrylpiperazin-1-ium-1-yl)-N-(2-furylmethyl)-N-methyl-acetamide CAS Name: 2-[4-(diphenylmethyl)-1-piperazin-1-iumyl]-N-(2-furanylmethyl)-N-methylacetamide IUPAC Name: 2-(4-benzhydrylpiperazin-1-ium-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide Traditional Name: 2-(4-benzhydrylpiperazin-1-ium-1-yl)-N-(2-furfuryl)-N-methyl-acetamide Formula: C25H30N3O2+ MolecularWeight: 404.5246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CO1)C(=O)C[NH+]2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC=CO1)C(=O)C[NH+]2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H29N3O2/c1-26(19-23-13-8-18-30-23)24(29)20-27-14-16-28(17-15-27)25(21-9-4-2-5-10-21)22-11-6-3-7-12-22/h2-13,18,25H,14-17,19-20H2,1H3/p+1