N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-6-methyl-pyridine-3-carboxamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-6-methyl-pyridine-3-carboxamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-6-methyl-pyridine-3-carboxamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazin-4-iumyl)phenyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-6-methylpyridine-3-carboxamide Traditional Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-6-methyl-nicotinamide Formula: C18H22ClN4O+ MolecularWeight: 345.84648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21ClN4O/c1-13-3-4-14(12-20-13)18(24)21-16-11-15(19)5-6-17(16)23-9-7-22(2)8-10-23/h3-6,11-12H,7-10H2,1-2H3,(H,21,24)/p+1