1-[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: 1-[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-[1-(4-chlorophenyl)-2,5-dimethyl-3-pyrrolyl]-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-[1-(4-chlorophenyl)-2,5-dimethylpyrrol-3-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methylene-(4-methylpiperazin-4-ium-1-yl)amine Formula: C18H24ClN4+ MolecularWeight: 331.86296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)C=NN3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)/C=N\N3CC[NH+](CC3)C

InChI

InChI=1S/C18H23ClN4/c1-14-12-16(13-20-22-10-8-21(3)9-11-22)15(2)23(14)18-6-4-17(19)5-7-18/h4-7,12-13H,8-11H2,1-3H3/p+1/b20-13-