1-(3-methoxy-4-phenylmethoxy-phenyl)-N-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanimine

Systemtic Name: 1-(3-methoxy-4-phenylmethoxy-phenyl)-N-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanimine Openeye Name: 1-(4-benzyloxy-3-methoxy-phenyl)-N-(4-benzylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-(3-methoxy-4-phenylmethoxyphenyl)-N-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanimine IUPAC Name: N-(4-benzylpiperazin-4-ium-1-yl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine Traditional Name: (Z)-(4-benzoxy-3-methoxy-benzylidene)-(4-benzylpiperazin-4-ium-1-yl)amine Formula: C26H30N3O2+ MolecularWeight: 416.5353

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NN2CC[NH+](CC2)CC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N\N2CC[NH+](CC2)CC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O2/c1-30-26-18-24(12-13-25(26)31-21-23-10-6-3-7-11-23)19-27-29-16-14-28(15-17-29)20-22-8-4-2-5-9-22/h2-13,18-19H,14-17,20-21H2,1H3/p+1/b27-19-