N-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]-1-(1-methylpyrrol-2-yl)methanimine

Systemtic Name: N-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]-1-(1-methylpyrrol-2-yl)methanimine Openeye Name: N-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]-1-(1-methylpyrrol-2-yl)methanimine CAS Name: N-[4-[(2-chlorophenyl)methyl]-1-piperazin-4-iumyl]-1-(1-methyl-2-pyrrolyl)methanimine IUPAC Name: N-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]-1-(1-methylpyrrol-2-yl)methanimine Traditional Name: (E)-[4-(2-chlorobenzyl)piperazin-4-ium-1-yl]-[(1-methylpyrrol-2-yl)methylene]amine Formula: C17H22ClN4+ MolecularWeight: 317.83638

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C=NN2CC[NH+](CC2)CC3=CC=CC=C3Cl

Isomeric SMILES

CN1C=CC=C1/C=N/N2CC[NH+](CC2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C17H21ClN4/c1-20-8-4-6-16(20)13-19-22-11-9-21(10-12-22)14-15-5-2-3-7-17(15)18/h2-8,13H,9-12,14H2,1H3/p+1/b19-13+