[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl] 6,8-bis(bromanyl)-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl] 6,8-bis(bromanyl)-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl] 6,8-dibromo-2-phenyl-quinoline-4-carboxylate CAS Name: 6,8-dibromo-2-phenyl-4-quinolinecarboxylic acid [2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl] 6,8-dibromo-2-phenylquinoline-4-carboxylate Traditional Name: 6,8-dibromo-2-phenyl-cinchoninic acid [2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl] ester Formula: C22H15Br2N3O4 MolecularWeight: 545.1802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)COC(=O)C2=CC(=NC3=C(C=C(C=C23)Br)Br)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NO1)NC(=O)COC(=O)C2=CC(=NC3=C(C=C(C=C23)Br)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H15Br2N3O4/c1-12-7-19(27-31-12)26-20(28)11-30-22(29)16-10-18(13-5-3-2-4-6-13)25-21-15(16)8-14(23)9-17(21)24/h2-10H,11H2,1H3,(H,26,27,28)