(2-ethanoyl-4,6-dimethyl-phenyl) 1-propan-2-ylindazole-3-carboxylate

Systemtic Name: (2-ethanoyl-4,6-dimethyl-phenyl) 1-propan-2-ylindazole-3-carboxylate Openeye Name: (2-acetyl-4,6-dimethyl-phenyl) 1-isopropylindazole-3-carboxylate CAS Name: 1-propan-2-yl-3-indazolecarboxylic acid (2-acetyl-4,6-dimethylphenyl) ester IUPAC Name: (2-acetyl-4,6-dimethylphenyl) 1-propan-2-ylindazole-3-carboxylate Traditional Name: 1-isopropylindazole-3-carboxylic acid (2-acetyl-4,6-dimethyl-phenyl) ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)C)OC(=O)C2=NN(C3=CC=CC=C32)C(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)C)OC(=O)C2=NN(C3=CC=CC=C32)C(C)C)C

InChI

InChI=1S/C21H22N2O3/c1-12(2)23-18-9-7-6-8-16(18)19(22-23)21(25)26-20-14(4)10-13(3)11-17(20)15(5)24/h6-12H,1-5H3