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

Systemtic Name: (4-butoxy-1-methyl-7-nitro-2-oxidanylidene-quinolin-3-yl) ethanoate Openeye Name: (4-butoxy-1-methyl-7-nitro-2-oxo-3-quinolyl) acetate CAS Name: acetic acid (4-butoxy-1-methyl-7-nitro-2-oxo-3-quinolinyl) ester IUPAC Name: (4-butoxy-1-methyl-7-nitro-2-oxoquinolin-3-yl) acetate Traditional Name: acetic acid (4-butoxy-2-keto-1-methyl-7-nitro-3-quinolyl) ester Formula: C16H18N2O6 MolecularWeight: 334.32392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O6/c1-4-5-8-23-14-12-7-6-11(18(21)22)9-13(12)17(3)16(20)15(14)24-10(2)19/h6-7,9H,4-5,8H2,1-3H3