1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium

Systemtic Name: 1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium Openeye Name: 1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium CAS Name: 1-[(4,5-dimethoxy-2-methylphenyl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium IUPAC Name: 1-[(4,5-dimethoxy-2-methylphenyl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium Traditional Name: 1-(4,5-dimethoxy-2-methyl-benzyl)-4-(3-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(=CC=C3)OC)OC)OC

Isomeric SMILES

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

InChI

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