2-[(2-ethyl-6-methyl-phenyl)methylcarbamoyl]-3-oxidanylidene-1H-indazole-4-carboxylic acid

Systemtic Name: 2-[(2-ethyl-6-methyl-phenyl)methylcarbamoyl]-3-oxidanylidene-1H-indazole-4-carboxylic acid Openeye Name: 2-[(2-ethyl-6-methyl-phenyl)methylcarbamoyl]-3-oxo-1H-indazole-4-carboxylic acid CAS Name: 2-[[(2-ethyl-6-methylphenyl)methylamino]-oxomethyl]-3-oxo-1H-indazole-4-carboxylic acid IUPAC Name: 2-[(2-ethyl-6-methylphenyl)methylcarbamoyl]-3-oxo-1H-indazole-4-carboxylic acid Traditional Name: 2-[(2-ethyl-6-methyl-benzyl)carbamoyl]-3-keto-indazoline-4-carboxylic acid Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1CNC(=O)N2C(=O)C3=C(C=CC=C3N2)C(=O)O)C

Isomeric SMILES

CCC1=CC=CC(=C1CNC(=O)N2C(=O)C3=C(C=CC=C3N2)C(=O)O)C

InChI

InChI=1S/C19H19N3O4/c1-3-12-7-4-6-11(2)14(12)10-20-19(26)22-17(23)16-13(18(24)25)8-5-9-15(16)21-22/h4-9,21H,3,10H2,1-2H3,(H,20,26)(H,24,25)