N-butyl-5-(4-cyclopentylpiperazin-4-ium-1-yl)carbonyl-4-oxidanylidene-1-propan-2-yl-pyridine-3-carboxamide

Systemtic Name: N-butyl-5-(4-cyclopentylpiperazin-4-ium-1-yl)carbonyl-4-oxidanylidene-1-propan-2-yl-pyridine-3-carboxamide Openeye Name: N-butyl-5-(4-cyclopentylpiperazin-4-ium-1-carbonyl)-1-isopropyl-4-oxo-pyridine-3-carboxamide CAS Name: N-butyl-5-[(4-cyclopentyl-1-piperazin-4-iumyl)-oxomethyl]-4-oxo-1-propan-2-yl-3-pyridinecarboxamide IUPAC Name: N-butyl-5-(4-cyclopentylpiperazin-4-ium-1-carbonyl)-4-oxo-1-propan-2-ylpyridine-3-carboxamide Traditional Name: N-butyl-5-(4-cyclopentylpiperazin-4-ium-1-carbonyl)-1-isopropyl-4-keto-nicotinamide Formula: C23H37N4O3+ MolecularWeight: 417.56488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CC[NH+](CC2)C3CCCC3)C(C)C

Isomeric SMILES

CCCCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CC[NH+](CC2)C3CCCC3)C(C)C

InChI

InChI=1S/C23H36N4O3/c1-4-5-10-24-22(29)19-15-27(17(2)3)16-20(21(19)28)23(30)26-13-11-25(12-14-26)18-8-6-7-9-18/h15-18H,4-14H2,1-3H3,(H,24,29)/p+1