1-(3-methylbutyl)-2-oxidanyl-4-oxidanylidene-N-(pyridin-4-ylmethyl)quinoline-3-carboxamide

Systemtic Name: 1-(3-methylbutyl)-2-oxidanyl-4-oxidanylidene-N-(pyridin-4-ylmethyl)quinoline-3-carboxamide Openeye Name: 2-hydroxy-1-isopentyl-4-oxo-N-(4-pyridylmethyl)quinoline-3-carboxamide CAS Name: 2-hydroxy-1-(3-methylbutyl)-4-oxo-N-(pyridin-4-ylmethyl)-3-quinolinecarboxamide IUPAC Name: 2-hydroxy-1-(3-methylbutyl)-4-oxo-N-(pyridin-4-ylmethyl)quinoline-3-carboxamide Traditional Name: 2-hydroxy-1-isoamyl-4-keto-N-(4-pyridylmethyl)quinoline-3-carboxamide Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NCC3=CC=NC=C3

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C21H23N3O3/c1-14(2)9-12-24-17-6-4-3-5-16(17)19(25)18(21(24)27)20(26)23-13-15-7-10-22-11-8-15/h3-8,10-11,14,27H,9,12-13H2,1-2H3,(H,23,26)