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

Systemtic Name: 1-(3-methylbutyl)-N-(4-nitrophenyl)-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 2-hydroxy-1-isopentyl-N-(4-nitrophenyl)-4-oxo-quinoline-3-carboxamide CAS Name: 2-hydroxy-1-(3-methylbutyl)-N-(4-nitrophenyl)-4-oxo-3-quinolinecarboxamide IUPAC Name: 2-hydroxy-1-(3-methylbutyl)-N-(4-nitrophenyl)-4-oxoquinoline-3-carboxamide Traditional Name: 2-hydroxy-1-isoamyl-4-keto-N-(4-nitrophenyl)quinoline-3-carboxamide Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O5/c1-13(2)11-12-23-17-6-4-3-5-16(17)19(25)18(21(23)27)20(26)22-14-7-9-15(10-8-14)24(28)29/h3-10,13,27H,11-12H2,1-2H3,(H,22,26)