6-[4-[(2-bromophenyl)carbamoyloxymethyl]imidazol-1-yl]-2-oxidanylidene-7-(trifluoromethyl)-1H-quinoline-3-carboxylic acid

Systemtic Name: 6-[4-[(2-bromophenyl)carbamoyloxymethyl]imidazol-1-yl]-2-oxidanylidene-7-(trifluoromethyl)-1H-quinoline-3-carboxylic acid Openeye Name: 6-[4-[(2-bromophenyl)carbamoyloxymethyl]imidazol-1-yl]-2-oxo-7-(trifluoromethyl)-1H-quinoline-3-carboxylic acid CAS Name: 6-[4-[[(2-bromoanilino)-oxomethoxy]methyl]-1-imidazolyl]-2-oxo-7-(trifluoromethyl)-1H-quinoline-3-carboxylic acid IUPAC Name: 6-[4-[(2-bromophenyl)carbamoyloxymethyl]imidazol-1-yl]-2-oxo-7-(trifluoromethyl)-1H-quinoline-3-carboxylic acid Traditional Name: 6-[4-[(2-bromophenyl)carbamoyloxymethyl]imidazol-1-yl]-2-keto-7-(trifluoromethyl)-1H-quinoline-3-carboxylic acid Formula: C22H14BrF3N4O5 MolecularWeight: 551.26957

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)OCC2=CN(C=N2)C3=C(C=C4C(=C3)C=C(C(=O)N4)C(=O)O)C(F)(F)F)Br

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)OCC2=CN(C=N2)C3=C(C=C4C(=C3)C=C(C(=O)N4)C(=O)O)C(F)(F)F)Br

InChI

InChI=1S/C22H14BrF3N4O5/c23-15-3-1-2-4-16(15)29-21(34)35-9-12-8-30(10-27-12)18-6-11-5-13(20(32)33)19(31)28-17(11)7-14(18)22(24,25)26/h1-8,10H,9H2,(H,28,31)(H,29,34)(H,32,33)