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

Systemtic Name: 1-[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-[1-(4-ethoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-[1-(4-ethoxyphenyl)-2,5-dimethylpyrrol-3-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-(2,5-dimethyl-1-p-phenetyl-pyrrol-3-yl)methylene-(4-methylpiperazin-4-ium-1-yl)amine Formula: C20H29N4O+ MolecularWeight: 341.47046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=CC(=C2C)C=NN3CC[NH+](CC3)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=CC(=C2C)/C=N\N3CC[NH+](CC3)C)C

InChI

InChI=1S/C20H28N4O/c1-5-25-20-8-6-19(7-9-20)24-16(2)14-18(17(24)3)15-21-23-12-10-22(4)11-13-23/h6-9,14-15H,5,10-13H2,1-4H3/p+1/b21-15-