N-[(4-methylphenyl)-(5-nitro-8-oxidanyl-quinolin-7-yl)methyl]pentanamide

Systemtic Name: N-[(4-methylphenyl)-(5-nitro-8-oxidanyl-quinolin-7-yl)methyl]pentanamide Openeye Name: N-[(8-hydroxy-5-nitro-7-quinolyl)-(p-tolyl)methyl]pentanamide CAS Name: N-[(8-hydroxy-5-nitro-7-quinolinyl)-(4-methylphenyl)methyl]pentanamide IUPAC Name: N-[(8-hydroxy-5-nitroquinolin-7-yl)-(4-methylphenyl)methyl]pentanamide Traditional Name: N-[(8-hydroxy-5-nitro-7-quinolyl)-(p-tolyl)methyl]valeramide Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(C1=CC=C(C=C1)C)C2=CC(=C3C=CC=NC3=C2O)[N+](=O)[O-]

Isomeric SMILES

CCCCC(=O)NC(C1=CC=C(C=C1)C)C2=CC(=C3C=CC=NC3=C2O)[N+](=O)[O-]

InChI

InChI=1S/C22H23N3O4/c1-3-4-7-19(26)24-20(15-10-8-14(2)9-11-15)17-13-18(25(28)29)16-6-5-12-23-21(16)22(17)27/h5-6,8-13,20,27H,3-4,7H2,1-2H3,(H,24,26)