1-cyclohexyl-N-cyclopropyl-5-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]carbonyl-4-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 1-cyclohexyl-N-cyclopropyl-5-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]carbonyl-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 1-cyclohexyl-N-cyclopropyl-5-[4-(m-tolylmethyl)piperazin-4-ium-1-carbonyl]-4-oxo-pyridine-3-carboxamide CAS Name: 1-cyclohexyl-N-cyclopropyl-5-[[4-[(3-methylphenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]-4-oxo-3-pyridinecarboxamide IUPAC Name: 1-cyclohexyl-N-cyclopropyl-5-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-carbonyl]-4-oxopyridine-3-carboxamide Traditional Name: 1-cyclohexyl-N-cyclopropyl-4-keto-5-[4-(3-methylbenzyl)piperazin-4-ium-1-carbonyl]nicotinamide Formula: C28H37N4O3+ MolecularWeight: 477.61838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C(=O)C3=CN(C=C(C3=O)C(=O)NC4CC4)C5CCCCC5

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C(=O)C3=CN(C=C(C3=O)C(=O)NC4CC4)C5CCCCC5

InChI

InChI=1S/C28H36N4O3/c1-20-6-5-7-21(16-20)17-30-12-14-31(15-13-30)28(35)25-19-32(23-8-3-2-4-9-23)18-24(26(25)33)27(34)29-22-10-11-22/h5-7,16,18-19,22-23H,2-4,8-15,17H2,1H3,(H,29,34)/p+1