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

Systemtic Name: 1-[1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-[1-(2-furylmethyl)-2,5-dimethyl-pyrrol-3-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-[1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolyl]-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-[1-(furan-2-ylmethyl)-2,5-dimethylpyrrol-3-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-[1-(2-furfuryl)-2,5-dimethyl-pyrrol-3-yl]methylene-(4-methylpiperazin-4-ium-1-yl)amine Formula: C17H25N4O+ MolecularWeight: 301.4066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CO2)C)C=NN3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CO2)C)/C=N\N3CC[NH+](CC3)C

InChI

InChI=1S/C17H24N4O/c1-14-11-16(12-18-20-8-6-19(3)7-9-20)15(2)21(14)13-17-5-4-10-22-17/h4-5,10-12H,6-9,13H2,1-3H3/p+1/b18-12-