diethyl 2-(3-bromanyl-8-nitro-quinolin-4-yl)propanedioate

Systemtic Name: diethyl 2-(3-bromanyl-8-nitro-quinolin-4-yl)propanedioate Openeye Name: diethyl 2-(3-bromo-8-nitro-4-quinolyl)propanedioate CAS Name: 2-(3-bromo-8-nitro-4-quinolinyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(3-bromo-8-nitroquinolin-4-yl)propanedioate Traditional Name: 2-(3-bromo-8-nitro-4-quinolyl)malonic acid diethyl ester Formula: C16H15BrN2O6 MolecularWeight: 411.2041

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C2C=CC=C(C2=NC=C1Br)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=C2C=CC=C(C2=NC=C1Br)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C16H15BrN2O6/c1-3-24-15(20)13(16(21)25-4-2)12-9-6-5-7-11(19(22)23)14(9)18-8-10(12)17/h5-8,13H,3-4H2,1-2H3