1-[[1-(6-methoxypyridin-3-yl)pyrrol-2-yl]methyl]-4-methyl-piperazin-4-ium

Systemtic Name: 1-[[1-(6-methoxypyridin-3-yl)pyrrol-2-yl]methyl]-4-methyl-piperazin-4-ium Openeye Name: 1-[[1-(6-methoxy-3-pyridyl)pyrrol-2-yl]methyl]-4-methyl-piperazin-4-ium CAS Name: 1-[[1-(6-methoxy-3-pyridinyl)-2-pyrrolyl]methyl]-4-methylpiperazin-4-ium IUPAC Name: 1-[[1-(6-methoxypyridin-3-yl)pyrrol-2-yl]methyl]-4-methylpiperazin-4-ium Traditional Name: 1-[[1-(6-methoxy-3-pyridyl)pyrrol-2-yl]methyl]-4-methyl-piperazin-4-ium Formula: C16H23N4O+ MolecularWeight: 287.38002

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC2=CC=CN2C3=CN=C(C=C3)OC

Isomeric SMILES

C[NH+]1CCN(CC1)CC2=CC=CN2C3=CN=C(C=C3)OC

InChI

InChI=1S/C16H22N4O/c1-18-8-10-19(11-9-18)13-15-4-3-7-20(15)14-5-6-16(21-2)17-12-14/h3-7,12H,8-11,13H2,1-2H3/p+1