(4-butoxy-7-nitro-2-oxidanylidene-1H-quinolin-3-yl) ethanoate

Systemtic Name: (4-butoxy-7-nitro-2-oxidanylidene-1H-quinolin-3-yl) ethanoate Openeye Name: (4-butoxy-7-nitro-2-oxo-1H-quinolin-3-yl) acetate CAS Name: acetic acid (4-butoxy-7-nitro-2-oxo-1H-quinolin-3-yl) ester IUPAC Name: (4-butoxy-7-nitro-2-oxo-1H-quinolin-3-yl) acetate Traditional Name: acetic acid (4-butoxy-2-keto-7-nitro-1H-quinolin-3-yl) ester Formula: C15H16N2O6 MolecularWeight: 320.29734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=O)NC2=C1C=CC(=C2)[N+](=O)[O-])OC(=O)C

Isomeric SMILES

CCCCOC1=C(C(=O)NC2=C1C=CC(=C2)[N+](=O)[O-])OC(=O)C

InChI

InChI=1S/C15H16N2O6/c1-3-4-7-22-13-11-6-5-10(17(20)21)8-12(11)16-15(19)14(13)23-9(2)18/h5-6,8H,3-4,7H2,1-2H3,(H,16,19)