1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-4-(4-methoxyphenyl)piperazin-1-ium

Systemtic Name: 1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-4-(4-methoxyphenyl)piperazin-1-ium Openeye Name: 1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-4-(4-methoxyphenyl)piperazin-1-ium CAS Name: 1-[(4,5-dimethoxy-2-methylphenyl)methyl]-4-(4-methoxyphenyl)piperazin-1-ium IUPAC Name: 1-[(4,5-dimethoxy-2-methylphenyl)methyl]-4-(4-methoxyphenyl)piperazin-1-ium Traditional Name: 1-(4,5-dimethoxy-2-methyl-benzyl)-4-(4-methoxyphenyl)piperazin-1-ium Formula: C21H29N2O3+ MolecularWeight: 357.46656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC)OC)OC

InChI

InChI=1S/C21H28N2O3/c1-16-13-20(25-3)21(26-4)14-17(16)15-22-9-11-23(12-10-22)18-5-7-19(24-2)8-6-18/h5-8,13-14H,9-12,15H2,1-4H3/p+1