N-[(5-nitro-8-oxidanyl-quinolin-7-yl)-phenyl-methyl]butanamide

Systemtic Name: N-[(5-nitro-8-oxidanyl-quinolin-7-yl)-phenyl-methyl]butanamide Openeye Name: N-[(8-hydroxy-5-nitro-7-quinolyl)-phenyl-methyl]butanamide CAS Name: N-[(8-hydroxy-5-nitro-7-quinolinyl)-phenylmethyl]butanamide IUPAC Name: N-[(8-hydroxy-5-nitroquinolin-7-yl)-phenylmethyl]butanamide Traditional Name: N-[(8-hydroxy-5-nitro-7-quinolyl)-phenyl-methyl]butyramide Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O4/c1-2-7-17(24)22-18(13-8-4-3-5-9-13)15-12-16(23(26)27)14-10-6-11-21-19(14)20(15)25/h3-6,8-12,18,25H,2,7H2,1H3,(H,22,24)