2-[(5-fluoranyl-2-methyl-phenyl)methylcarbamoyl]-3-oxidanylidene-1H-indazole-7-carboxylic acid

Systemtic Name: 2-[(5-fluoranyl-2-methyl-phenyl)methylcarbamoyl]-3-oxidanylidene-1H-indazole-7-carboxylic acid Openeye Name: 2-[(5-fluoro-2-methyl-phenyl)methylcarbamoyl]-3-oxo-1H-indazole-7-carboxylic acid CAS Name: 2-[[(5-fluoro-2-methylphenyl)methylamino]-oxomethyl]-3-oxo-1H-indazole-7-carboxylic acid IUPAC Name: 2-[(5-fluoro-2-methylphenyl)methylcarbamoyl]-3-oxo-1H-indazole-7-carboxylic acid Traditional Name: 2-[(5-fluoro-2-methyl-benzyl)carbamoyl]-3-keto-indazoline-7-carboxylic acid Formula: C17H14FN3O4 MolecularWeight: 343.309163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)CNC(=O)N2C(=O)C3=C(N2)C(=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)F)CNC(=O)N2C(=O)C3=C(N2)C(=CC=C3)C(=O)O

InChI

InChI=1S/C17H14FN3O4/c1-9-5-6-11(18)7-10(9)8-19-17(25)21-15(22)12-3-2-4-13(16(23)24)14(12)20-21/h2-7,20H,8H2,1H3,(H,19,25)(H,23,24)