methyl 2-fluoranyl-5-[(6-oxidanylidene-1-phenyl-2,5-dihydro-1,2,4-triazin-3-yl)carbonylamino]benzoate

Systemtic Name: methyl 2-fluoranyl-5-[(6-oxidanylidene-1-phenyl-2,5-dihydro-1,2,4-triazin-3-yl)carbonylamino]benzoate Openeye Name: methyl 2-fluoro-5-[(6-oxo-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carbonyl)amino]benzoate CAS Name: 2-fluoro-5-[[oxo-(6-oxo-1-phenyl-2,5-dihydro-1,2,4-triazin-3-yl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-fluoro-5-[(6-oxo-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carbonyl)amino]benzoate Traditional Name: 2-fluoro-5-[(6-keto-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carbonyl)amino]benzoic acid methyl ester Formula: C18H15FN4O4 MolecularWeight: 370.334503

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)NC(=O)C2=NCC(=O)N(N2)C3=CC=CC=C3)F

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)NC(=O)C2=NCC(=O)N(N2)C3=CC=CC=C3)F

InChI

InChI=1S/C18H15FN4O4/c1-27-18(26)13-9-11(7-8-14(13)19)21-17(25)16-20-10-15(24)23(22-16)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,20,22)(H,21,25)