5-oxidanyl-N-[6-[(5-oxidanylpyridin-3-yl)carbonylamino]hexyl]pyridine-3-carboxamide hydrate hydrochloride

Systemtic Name: 5-oxidanyl-N-[6-[(5-oxidanylpyridin-3-yl)carbonylamino]hexyl]pyridine-3-carboxamide hydrate hydrochloride Openeye Name: 5-hydroxy-N-[6-[(5-hydroxypyridine-3-carbonyl)amino]hexyl]pyridine-3-carboxamide hydrate hydrochloride CAS Name: 5-hydroxy-N-[6-[[(5-hydroxy-3-pyridinyl)-oxomethyl]amino]hexyl]-3-pyridinecarboxamide hydrate hydrochloride IUPAC Name: 5-hydroxy-N-[6-[(5-hydroxypyridine-3-carbonyl)amino]hexyl]pyridine-3-carboxamide hydrate hydrochloride Traditional Name: 5-hydroxy-N-[6-[(5-hydroxynicotinoyl)amino]hexyl]nicotinamide hydrate hydrochloride Formula: C18H25ClN4O5 MolecularWeight: 412.8679

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC=C1O)C(=O)NCCCCCCNC(=O)C2=CC(=CN=C2)O.O.Cl

Isomeric SMILES

C1=C(C=NC=C1O)C(=O)NCCCCCCNC(=O)C2=CC(=CN=C2)O.O.Cl

InChI

InChI=1S/C18H22N4O4.ClH.H2O/c23-15-7-13(9-19-11-15)17(25)21-5-3-1-2-4-6-22-18(26)14-8-16(24)12-20-10-14;;/h7-12,23-24H,1-6H2,(H,21,25)(H,22,26);1H;1H2