1-[(2,4-dimethoxyphenyl)methyl]-4-[(1-methylpyrrol-2-yl)methyl]piperazin-4-ium

Systemtic Name: 1-[(2,4-dimethoxyphenyl)methyl]-4-[(1-methylpyrrol-2-yl)methyl]piperazin-4-ium Openeye Name: 1-[(2,4-dimethoxyphenyl)methyl]-4-[(1-methylpyrrol-2-yl)methyl]piperazin-4-ium CAS Name: 1-[(2,4-dimethoxyphenyl)methyl]-4-[(1-methyl-2-pyrrolyl)methyl]piperazin-4-ium IUPAC Name: 1-[(2,4-dimethoxyphenyl)methyl]-4-[(1-methylpyrrol-2-yl)methyl]piperazin-4-ium Traditional Name: 1-(2,4-dimethoxybenzyl)-4-[(1-methylpyrrol-2-yl)methyl]piperazin-4-ium Formula: C19H28N3O2+ MolecularWeight: 330.44452

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C[NH+]2CCN(CC2)CC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CN1C=CC=C1C[NH+]2CCN(CC2)CC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C19H27N3O2/c1-20-8-4-5-17(20)15-22-11-9-21(10-12-22)14-16-6-7-18(23-2)13-19(16)24-3/h4-8,13H,9-12,14-15H2,1-3H3/p+1