[2-(1-adamantyl)-2-oxidanylidene-ethyl] 1H-indazole-3-carboxylate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] 1H-indazole-3-carboxylate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)C4=NNC5=CC=CC=C54

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)C4=NNC5=CC=CC=C54

InChI

InChI=1S/C20H22N2O3/c23-17(20-8-12-5-13(9-20)7-14(6-12)10-20)11-25-19(24)18-15-3-1-2-4-16(15)21-22-18/h1-4,12-14H,5-11H2,(H,21,22)