1-(2,3-dimethoxyphenyl)-N-[4-(diphenylmethyl)piperazin-4-ium-1-yl]methanimine

Systemtic Name: 1-(2,3-dimethoxyphenyl)-N-[4-(diphenylmethyl)piperazin-4-ium-1-yl]methanimine Openeye Name: N-(4-benzhydrylpiperazin-4-ium-1-yl)-1-(2,3-dimethoxyphenyl)methanimine CAS Name: 1-(2,3-dimethoxyphenyl)-N-[4-(diphenylmethyl)-1-piperazin-4-iumyl]methanimine IUPAC Name: N-(4-benzhydrylpiperazin-4-ium-1-yl)-1-(2,3-dimethoxyphenyl)methanimine Traditional Name: (Z)-(4-benzhydrylpiperazin-4-ium-1-yl)-(2,3-dimethoxybenzylidene)amine Formula: C26H30N3O2+ MolecularWeight: 416.5353

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C=NN2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1OC)/C=N\N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H29N3O2/c1-30-24-15-9-14-23(26(24)31-2)20-27-29-18-16-28(17-19-29)25(21-10-5-3-6-11-21)22-12-7-4-8-13-22/h3-15,20,25H,16-19H2,1-2H3/p+1/b27-20-