1-(cyclohexylmethyl)-N-cyclopropyl-4-oxidanylidene-5-(4-piperidin-1-ium-1-ylpiperidin-1-yl)carbonyl-pyridine-3-carboxamide

Systemtic Name: 1-(cyclohexylmethyl)-N-cyclopropyl-4-oxidanylidene-5-(4-piperidin-1-ium-1-ylpiperidin-1-yl)carbonyl-pyridine-3-carboxamide Openeye Name: 1-(cyclohexylmethyl)-N-cyclopropyl-4-oxo-5-(4-piperidin-1-ium-1-ylpiperidine-1-carbonyl)pyridine-3-carboxamide CAS Name: 1-(cyclohexylmethyl)-N-cyclopropyl-4-oxo-5-[oxo-[4-(1-piperidin-1-iumyl)-1-piperidinyl]methyl]-3-pyridinecarboxamide IUPAC Name: 1-(cyclohexylmethyl)-N-cyclopropyl-4-oxo-5-(4-piperidin-1-ium-1-ylpiperidine-1-carbonyl)pyridine-3-carboxamide Traditional Name: 1-(cyclohexylmethyl)-N-cyclopropyl-4-keto-5-(4-piperidin-1-ium-1-ylpiperidine-1-carbonyl)nicotinamide Formula: C27H41N4O3+ MolecularWeight: 469.63944

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C=C(C(=O)C(=C2)C(=O)N3CCC(CC3)[NH+]4CCCCC4)C(=O)NC5CC5

Isomeric SMILES

C1CCC(CC1)CN2C=C(C(=O)C(=C2)C(=O)N3CCC(CC3)[NH+]4CCCCC4)C(=O)NC5CC5

InChI

InChI=1S/C27H40N4O3/c32-25-23(26(33)28-21-9-10-21)18-29(17-20-7-3-1-4-8-20)19-24(25)27(34)31-15-11-22(12-16-31)30-13-5-2-6-14-30/h18-22H,1-17H2,(H,28,33)/p+1