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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O5/c1-2-3-6-13-23-17-8-5-4-7-16(17)19(25)18(21(23)27)20(26)22-14-9-11-15(12-10-14)24(28)29/h4-5,7-12,27H,2-3,6,13H2,1H3,(H,22,26)