methyl 3-nitro-5-[[6-(trifluoromethyloxy)-3,4-dihydro-2H-quinolin-1-yl]carbonyl]benzoate

Systemtic Name: methyl 3-nitro-5-[[6-(trifluoromethyloxy)-3,4-dihydro-2H-quinolin-1-yl]carbonyl]benzoate Openeye Name: methyl 3-nitro-5-[6-(trifluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]benzoate CAS Name: 3-nitro-5-[oxo-[6-(trifluoromethoxy)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-5-[6-(trifluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]benzoate Traditional Name: 3-nitro-5-[6-(trifluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]benzoic acid methyl ester Formula: C19H15F3N2O6 MolecularWeight: 424.32741

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)N2CCCC3=C2C=CC(=C3)OC(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)N2CCCC3=C2C=CC(=C3)OC(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H15F3N2O6/c1-29-18(26)13-7-12(8-14(9-13)24(27)28)17(25)23-6-2-3-11-10-15(4-5-16(11)23)30-19(20,21)22/h4-5,7-10H,2-3,6H2,1H3