1-(cyclohexylmethyl)-N-ethyl-5-[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]carbonyl-4-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 1-(cyclohexylmethyl)-N-ethyl-5-[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]carbonyl-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 1-(cyclohexylmethyl)-N-ethyl-5-[4-(6-methylpyridin-1-ium-2-yl)piperazine-1-carbonyl]-4-oxo-pyridine-3-carboxamide CAS Name: 1-(cyclohexylmethyl)-N-ethyl-5-[[4-(6-methyl-2-pyridin-1-iumyl)-1-piperazinyl]-oxomethyl]-4-oxo-3-pyridinecarboxamide IUPAC Name: 1-(cyclohexylmethyl)-N-ethyl-5-[4-(6-methylpyridin-1-ium-2-yl)piperazine-1-carbonyl]-4-oxopyridine-3-carboxamide Traditional Name: 1-(cyclohexylmethyl)-N-ethyl-4-keto-5-[4-(6-methylpyridin-1-ium-2-yl)piperazine-1-carbonyl]nicotinamide Formula: C26H36N5O3+ MolecularWeight: 466.59574

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)C3=CC=CC(=[NH+]3)C)CC4CCCCC4

Isomeric SMILES

CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)C3=CC=CC(=[NH+]3)C)CC4CCCCC4

InChI

InChI=1S/C26H35N5O3/c1-3-27-25(33)21-17-29(16-20-9-5-4-6-10-20)18-22(24(21)32)26(34)31-14-12-30(13-15-31)23-11-7-8-19(2)28-23/h7-8,11,17-18,20H,3-6,9-10,12-16H2,1-2H3,(H,27,33)/p+1