N-[(4-methoxyphenyl)-(5-nitro-8-oxidanyl-quinolin-7-yl)methyl]butanamide

Systemtic Name: N-[(4-methoxyphenyl)-(5-nitro-8-oxidanyl-quinolin-7-yl)methyl]butanamide Openeye Name: N-[(8-hydroxy-5-nitro-7-quinolyl)-(4-methoxyphenyl)methyl]butanamide CAS Name: N-[(8-hydroxy-5-nitro-7-quinolinyl)-(4-methoxyphenyl)methyl]butanamide IUPAC Name: N-[(8-hydroxy-5-nitroquinolin-7-yl)-(4-methoxyphenyl)methyl]butanamide Traditional Name: N-[(8-hydroxy-5-nitro-7-quinolyl)-(4-methoxyphenyl)methyl]butyramide Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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