[2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl] 1H-indazole-3-carboxylate

Systemtic Name: [2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl] 1H-indazole-3-carboxylate Openeye Name: [2-(2,5-dimethylphenyl)-2-oxo-ethyl] 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid [2-(2,5-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid [2-(2,5-dimethylphenyl)-2-keto-ethyl] ester Formula: C18H16N2O3 MolecularWeight: 308.33124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)COC(=O)C2=NNC3=CC=CC=C32

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)COC(=O)C2=NNC3=CC=CC=C32

InChI

InChI=1S/C18H16N2O3/c1-11-7-8-12(2)14(9-11)16(21)10-23-18(22)17-13-5-3-4-6-15(13)19-20-17/h3-9H,10H2,1-2H3,(H,19,20)