[5,7-bis(chloranyl)-2-methyl-quinolin-8-yl] 3-nitrobenzoate

Systemtic Name: [5,7-bis(chloranyl)-2-methyl-quinolin-8-yl] 3-nitrobenzoate Openeye Name: (5,7-dichloro-2-methyl-8-quinolyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (5,7-dichloro-2-methyl-8-quinolinyl) ester IUPAC Name: (5,7-dichloro-2-methylquinolin-8-yl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (5,7-dichloro-2-methyl-8-quinolyl) ester Formula: C17H10Cl2N2O4 MolecularWeight: 377.1783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H10Cl2N2O4/c1-9-5-6-12-13(18)8-14(19)16(15(12)20-9)25-17(22)10-3-2-4-11(7-10)21(23)24/h2-8H,1H3