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

Systemtic Name: 7-[4-[(3-bromophenyl)carbamoyloxymethyl]imidazol-1-yl]-3-oxidanylidene-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylic acid Openeye Name: 7-[4-[(3-bromophenyl)carbamoyloxymethyl]imidazol-1-yl]-3-oxo-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylic acid CAS Name: 7-[4-[[(3-bromoanilino)-oxomethoxy]methyl]-1-imidazolyl]-3-oxo-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylic acid IUPAC Name: 7-[4-[(3-bromophenyl)carbamoyloxymethyl]imidazol-1-yl]-3-oxo-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylic acid Traditional Name: 7-[4-[(3-bromophenyl)carbamoyloxymethyl]imidazol-1-yl]-3-keto-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylic acid Formula: C21H13BrF3N5O5 MolecularWeight: 552.25763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC(=O)OCC2=CN(C=N2)C3=CC4=C(C=C3C(F)(F)F)NC(=O)C(=N4)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC(=O)OCC2=CN(C=N2)C3=CC4=C(C=C3C(F)(F)F)NC(=O)C(=N4)C(=O)O

InChI

InChI=1S/C21H13BrF3N5O5/c22-10-2-1-3-11(4-10)27-20(34)35-8-12-7-30(9-26-12)16-6-15-14(5-13(16)21(23,24)25)29-18(31)17(28-15)19(32)33/h1-7,9H,8H2,(H,27,34)(H,29,31)(H,32,33)