N-(5-chloranylpyridin-2-yl)-1-hexyl-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-1-hexyl-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-(5-chloro-2-pyridyl)-1-hexyl-2-hydroxy-4-oxo-quinoline-3-carboxamide CAS Name: N-(5-chloro-2-pyridinyl)-1-hexyl-2-hydroxy-4-oxo-3-quinolinecarboxamide IUPAC Name: N-(5-chloropyridin-2-yl)-1-hexyl-2-hydroxy-4-oxoquinoline-3-carboxamide Traditional Name: N-(5-chloro-2-pyridyl)-1-hexyl-2-hydroxy-4-keto-quinoline-3-carboxamide Formula: C21H22ClN3O3 MolecularWeight: 399.87068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClN3O3/c1-2-3-4-7-12-25-16-9-6-5-8-15(16)19(26)18(21(25)28)20(27)24-17-11-10-14(22)13-23-17/h5-6,8-11,13,28H,2-4,7,12H2,1H3,(H,23,24,27)