N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-6-morpholin-4-yl-pyridine-3-carboxamide

Systemtic Name: N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-6-morpholin-4-yl-pyridine-3-carboxamide Openeye Name: 6-morpholino-N-[2-[4-(m-tolyl)piperazin-1-ium-1-yl]ethyl]pyridine-3-carboxamide CAS Name: N-[2-[4-(3-methylphenyl)-1-piperazin-1-iumyl]ethyl]-6-(4-morpholinyl)-3-pyridinecarboxamide IUPAC Name: N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide Traditional Name: 6-morpholino-N-[2-[4-(m-tolyl)piperazin-1-ium-1-yl]ethyl]nicotinamide Formula: C23H32N5O2+ MolecularWeight: 410.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCNC(=O)C3=CN=C(C=C3)N4CCOCC4

Isomeric SMILES

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCNC(=O)C3=CN=C(C=C3)N4CCOCC4

InChI

InChI=1S/C23H31N5O2/c1-19-3-2-4-21(17-19)27-11-9-26(10-12-27)8-7-24-23(29)20-5-6-22(25-18-20)28-13-15-30-16-14-28/h2-6,17-18H,7-16H2,1H3,(H,24,29)/p+1