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

Systemtic Name: 1-[(2,4-dimethylphenyl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium Openeye Name: 1-[(2,4-dimethylphenyl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium CAS Name: 1-[(2,4-dimethylphenyl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium IUPAC Name: 1-[(2,4-dimethylphenyl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium Traditional Name: 1-(2,4-dimethylbenzyl)-4-(3-methoxyphenyl)piperazin-1-ium Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O/c1-16-7-8-18(17(2)13-16)15-21-9-11-22(12-10-21)19-5-4-6-20(14-19)23-3/h4-8,13-14H,9-12,15H2,1-3H3/p+1