ethyl 3-[6-bromanyl-1-(2-ethoxy-2-oxidanylidene-ethanoyl)-8-nitro-3,4-dihydro-2H-quinolin-2-yl]propanoate

Systemtic Name: ethyl 3-[6-bromanyl-1-(2-ethoxy-2-oxidanylidene-ethanoyl)-8-nitro-3,4-dihydro-2H-quinolin-2-yl]propanoate Openeye Name: ethyl 3-[6-bromo-1-(2-ethoxy-2-oxo-acetyl)-8-nitro-3,4-dihydro-2H-quinolin-2-yl]propanoate CAS Name: 3-[6-bromo-1-(2-ethoxy-1,2-dioxoethyl)-8-nitro-3,4-dihydro-2H-quinolin-2-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[6-bromo-1-(2-ethoxy-2-oxoacetyl)-8-nitro-3,4-dihydro-2H-quinolin-2-yl]propanoate Traditional Name: 3-(6-bromo-1-ethoxalyl-8-nitro-3,4-dihydro-2H-quinolin-2-yl)propionic acid ethyl ester Formula: C18H21BrN2O7 MolecularWeight: 457.27254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1CCC2=CC(=CC(=C2N1C(=O)C(=O)OCC)[N+](=O)[O-])Br

Isomeric SMILES

CCOC(=O)CCC1CCC2=CC(=CC(=C2N1C(=O)C(=O)OCC)[N+](=O)[O-])Br

InChI

InChI=1S/C18H21BrN2O7/c1-3-27-15(22)8-7-13-6-5-11-9-12(19)10-14(21(25)26)16(11)20(13)17(23)18(24)28-4-2/h9-10,13H,3-8H2,1-2H3