1-[(1-methylpyrrol-2-yl)methyl]-4-(pyridin-4-ylmethyl)piperazine-1,4-diium

Systemtic Name: 1-[(1-methylpyrrol-2-yl)methyl]-4-(pyridin-4-ylmethyl)piperazine-1,4-diium Openeye Name: 1-[(1-methylpyrrol-2-yl)methyl]-4-(4-pyridylmethyl)piperazine-1,4-diium CAS Name: 1-[(1-methyl-2-pyrrolyl)methyl]-4-(pyridin-4-ylmethyl)piperazine-1,4-diium IUPAC Name: 1-[(1-methylpyrrol-2-yl)methyl]-4-(pyridin-4-ylmethyl)piperazine-1,4-diium Traditional Name: 1-[(1-methylpyrrol-2-yl)methyl]-4-(4-pyridylmethyl)piperazine-1,4-diium Formula: C16H24N4+2 MolecularWeight: 272.38856

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C[NH+]2CC[NH+](CC2)CC3=CC=NC=C3

Isomeric SMILES

CN1C=CC=C1C[NH+]2CC[NH+](CC2)CC3=CC=NC=C3

InChI

InChI=1S/C16H22N4/c1-18-8-2-3-16(18)14-20-11-9-19(10-12-20)13-15-4-6-17-7-5-15/h2-8H,9-14H2,1H3/p+2