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

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-6-methyl-pyridine-3-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-6-methyl-pyridine-3-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)-3-methylphenyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methylphenyl]-6-methylpyridine-3-carboxamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-6-methyl-nicotinamide Formula: C20H27N4O+ MolecularWeight: 339.45458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O/c1-4-23-9-11-24(12-10-23)19-8-7-18(13-15(19)2)22-20(25)17-6-5-16(3)21-14-17/h5-8,13-14H,4,9-12H2,1-3H3,(H,22,25)/p+1