1-[(3,4-dimethoxyphenyl)methyl]-4-(2,5-dimethylphenyl)piperazin-1-ium

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-(2,5-dimethylphenyl)piperazin-1-ium Openeye Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-(2,5-dimethylphenyl)piperazin-1-ium CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-(2,5-dimethylphenyl)piperazin-1-ium IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-(2,5-dimethylphenyl)piperazin-1-ium Traditional Name: 1-(2,5-dimethylphenyl)-4-veratryl-piperazin-4-ium Formula: C21H29N2O2+ MolecularWeight: 341.46716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CC[NH+](CC2)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CC[NH+](CC2)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H28N2O2/c1-16-5-6-17(2)19(13-16)23-11-9-22(10-12-23)15-18-7-8-20(24-3)21(14-18)25-4/h5-8,13-14H,9-12,15H2,1-4H3/p+1