3-(3-chloranyl-4-methyl-phenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]propanamide

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]propanamide Openeye Name: 3-(3-chloro-4-methyl-phenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]propanamide CAS Name: 3-(3-chloro-4-methylphenyl)-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]propanamide IUPAC Name: 3-(3-chloro-4-methylphenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]propanamide Traditional Name: 3-(3-chloro-4-methyl-phenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]propionamide Formula: C20H26ClN4O+ MolecularWeight: 373.89964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC(=O)NC2=CN=C(C=C2)N3CC[NH+](CC3)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CCC(=O)NC2=CN=C(C=C2)N3CC[NH+](CC3)C)Cl

InChI

InChI=1S/C20H25ClN4O/c1-15-3-4-16(13-18(15)21)5-8-20(26)23-17-6-7-19(22-14-17)25-11-9-24(2)10-12-25/h3-4,6-7,13-14H,5,8-12H2,1-2H3,(H,23,26)/p+1