dimethyl 5-[[6-bromanyl-2-(4-ethylphenyl)quinolin-4-yl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[6-bromanyl-2-(4-ethylphenyl)quinolin-4-yl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[6-bromo-2-(4-ethylphenyl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[6-bromo-2-(4-ethylphenyl)-4-quinolinyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[6-bromo-2-(4-ethylphenyl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[6-bromo-2-(4-ethylphenyl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C28H23BrN2O5 MolecularWeight: 547.39662

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=CC(=CC(=C4)C(=O)OC)C(=O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=CC(=CC(=C4)C(=O)OC)C(=O)OC

InChI

InChI=1S/C28H23BrN2O5/c1-4-16-5-7-17(8-6-16)25-15-23(22-14-20(29)9-10-24(22)31-25)26(32)30-21-12-18(27(33)35-2)11-19(13-21)28(34)36-3/h5-15H,4H2,1-3H3,(H,30,32)