1-(3,5-dimethoxy-4-phenylmethoxy-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: 1-(3,5-dimethoxy-4-phenylmethoxy-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-(4-benzyloxy-3,5-dimethoxy-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-(3,5-dimethoxy-4-phenylmethoxyphenyl)-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-(3,5-dimethoxy-4-phenylmethoxyphenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-(4-benzoxy-3,5-dimethoxy-benzylidene)-(4-methylpiperazin-4-ium-1-yl)amine Formula: C21H28N3O3+ MolecularWeight: 370.46532

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)N=CC2=CC(=C(C(=C2)OC)OCC3=CC=CC=C3)OC

Isomeric SMILES

C[NH+]1CCN(CC1)/N=C\C2=CC(=C(C(=C2)OC)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C21H27N3O3/c1-23-9-11-24(12-10-23)22-15-18-13-19(25-2)21(20(14-18)26-3)27-16-17-7-5-4-6-8-17/h4-8,13-15H,9-12,16H2,1-3H3/p+1/b22-15-