1-(3,4-dimethoxyphenyl)-N-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]ethanimine

Systemtic Name: 1-(3,4-dimethoxyphenyl)-N-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]ethanimine Openeye Name: 1-(3,4-dimethoxyphenyl)-N-[4-(p-tolylmethyl)piperazin-4-ium-1-yl]ethanimine CAS Name: 1-(3,4-dimethoxyphenyl)-N-[4-[(4-methylphenyl)methyl]-1-piperazin-4-iumyl]ethanimine IUPAC Name: 1-(3,4-dimethoxyphenyl)-N-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]ethanimine Traditional Name: (E)-1-(3,4-dimethoxyphenyl)ethylidene-[4-(4-methylbenzyl)piperazin-4-ium-1-yl]amine Formula: C22H30N3O2+ MolecularWeight: 368.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)N=C(C)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)/N=C(\C)/C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H29N3O2/c1-17-5-7-19(8-6-17)16-24-11-13-25(14-12-24)23-18(2)20-9-10-21(26-3)22(15-20)27-4/h5-10,15H,11-14,16H2,1-4H3/p+1/b23-18+