N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-6-oxidanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-6-oxidanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-6-oxo-1H-pyridine-3-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)-3-methylphenyl]-6-oxo-1H-pyridine-3-carboxamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methylphenyl]-6-oxo-1H-pyridine-3-carboxamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-6-keto-1H-pyridine-3-carboxamide Formula: C19H25N4O2+ MolecularWeight: 341.4274

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CNC(=O)C=C3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CNC(=O)C=C3)C

InChI

InChI=1S/C19H24N4O2/c1-3-22-8-10-23(11-9-22)17-6-5-16(12-14(17)2)21-19(25)15-4-7-18(24)20-13-15/h4-7,12-13H,3,8-11H2,1-2H3,(H,20,24)(H,21,25)/p+1