N-[(E)-(2-nitrophenyl)methylideneamino]-2-oxidanyl-4-oxidanylidene-1-pentyl-quinoline-3-carboxamide

Systemtic Name: N-[(E)-(2-nitrophenyl)methylideneamino]-2-oxidanyl-4-oxidanylidene-1-pentyl-quinoline-3-carboxamide Openeye Name: 2-hydroxy-N-[(E)-(2-nitrophenyl)methyleneamino]-4-oxo-1-pentyl-quinoline-3-carboxamide CAS Name: 2-hydroxy-N-[(E)-(2-nitrophenyl)methylideneamino]-4-oxo-1-pentyl-3-quinolinecarboxamide IUPAC Name: 2-hydroxy-N-[(E)-(2-nitrophenyl)methylideneamino]-4-oxo-1-pentylquinoline-3-carboxamide Traditional Name: 1-amyl-2-hydroxy-4-keto-N-[(E)-(2-nitrobenzylidene)amino]quinoline-3-carboxamide Formula: C22H22N4O5 MolecularWeight: 422.43388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NN=CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O5/c1-2-3-8-13-25-18-12-7-5-10-16(18)20(27)19(22(25)29)21(28)24-23-14-15-9-4-6-11-17(15)26(30)31/h4-7,9-12,14,29H,2-3,8,13H2,1H3,(H,24,28)/b23-14+