2-[(2,6-dimethylphenyl)methylcarbamoyl]-3-oxidanylidene-1H-indazole-7-carboxylic acid

Systemtic Name: 2-[(2,6-dimethylphenyl)methylcarbamoyl]-3-oxidanylidene-1H-indazole-7-carboxylic acid Openeye Name: 2-[(2,6-dimethylphenyl)methylcarbamoyl]-3-oxo-1H-indazole-7-carboxylic acid CAS Name: 2-[[(2,6-dimethylphenyl)methylamino]-oxomethyl]-3-oxo-1H-indazole-7-carboxylic acid IUPAC Name: 2-[(2,6-dimethylphenyl)methylcarbamoyl]-3-oxo-1H-indazole-7-carboxylic acid Traditional Name: 2-[(2,6-dimethylbenzyl)carbamoyl]-3-keto-indazoline-7-carboxylic acid Formula: C18H17N3O4 MolecularWeight: 339.34528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O4/c1-10-5-3-6-11(2)14(10)9-19-18(25)21-16(22)12-7-4-8-13(17(23)24)15(12)20-21/h3-8,20H,9H2,1-2H3,(H,19,25)(H,23,24)