(2-methylquinolin-8-yl) 2-bromanyl-5-nitro-benzoate

Systemtic Name: (2-methylquinolin-8-yl) 2-bromanyl-5-nitro-benzoate Openeye Name: (2-methyl-8-quinolyl) 2-bromo-5-nitro-benzoate CAS Name: 2-bromo-5-nitrobenzoic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 2-bromo-5-nitrobenzoate Traditional Name: 2-bromo-5-nitro-benzoic acid (2-methyl-8-quinolyl) ester Formula: C17H11BrN2O4 MolecularWeight: 387.18424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Br)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Br)C=C1

InChI

InChI=1S/C17H11BrN2O4/c1-10-5-6-11-3-2-4-15(16(11)19-10)24-17(21)13-9-12(20(22)23)7-8-14(13)18/h2-9H,1H3