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

Systemtic Name: 2-ethoxy-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]pyridine-3-carboxamide Openeye Name: 2-ethoxy-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]pyridine-3-carboxamide CAS Name: 2-ethoxy-N-[4-(4-ethyl-1-piperazin-4-iumyl)-3-methylphenyl]-3-pyridinecarboxamide IUPAC Name: 2-ethoxy-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methylphenyl]pyridine-3-carboxamide Traditional Name: 2-ethoxy-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]nicotinamide Formula: C21H29N4O2+ MolecularWeight: 369.48056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N4O2/c1-4-24-11-13-25(14-12-24)19-9-8-17(15-16(19)3)23-20(26)18-7-6-10-22-21(18)27-5-2/h6-10,15H,4-5,11-14H2,1-3H3,(H,23,26)/p+1