ethyl 7-[4-(hydroxymethyl)imidazol-1-yl]-3-oxidanylidene-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylate

Systemtic Name: ethyl 7-[4-(hydroxymethyl)imidazol-1-yl]-3-oxidanylidene-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylate Openeye Name: ethyl 7-[4-(hydroxymethyl)imidazol-1-yl]-3-oxo-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylate CAS Name: 7-[4-(hydroxymethyl)-1-imidazolyl]-3-oxo-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-[4-(hydroxymethyl)imidazol-1-yl]-3-oxo-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylate Traditional Name: 3-keto-7-(4-methylolimidazol-1-yl)-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylic acid ethyl ester Formula: C16H13F3N4O4 MolecularWeight: 382.29403

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=C(C=C(C(=C2)N3C=C(N=C3)CO)C(F)(F)F)NC1=O

Isomeric SMILES

CCOC(=O)C1=NC2=C(C=C(C(=C2)N3C=C(N=C3)CO)C(F)(F)F)NC1=O

InChI

InChI=1S/C16H13F3N4O4/c1-2-27-15(26)13-14(25)22-10-3-9(16(17,18)19)12(4-11(10)21-13)23-5-8(6-24)20-7-23/h3-5,7,24H,2,6H2,1H3,(H,22,25)