ethyl (3aS,4S)-3a-methyl-3-oxidanylidene-4,5,6,7-tetrahydro-2H-indazole-4-carboxylate

Systemtic Name: ethyl (3aS,4S)-3a-methyl-3-oxidanylidene-4,5,6,7-tetrahydro-2H-indazole-4-carboxylate Openeye Name: ethyl (3aS,4S)-3a-methyl-3-oxo-4,5,6,7-tetrahydro-2H-indazole-4-carboxylate CAS Name: (3aS,4S)-3a-methyl-3-oxo-4,5,6,7-tetrahydro-2H-indazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl (3aS,4S)-3a-methyl-3-oxo-4,5,6,7-tetrahydro-2H-indazole-4-carboxylate Traditional Name: (3aS,4S)-3-keto-3a-methyl-4,5,6,7-tetrahydro-2H-indazole-4-carboxylic acid ethyl ester Formula: C11H16N2O3 MolecularWeight: 224.25634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCC2=NNC(=O)C12C

Isomeric SMILES

CCOC(=O)[C@H]1CCCC2=NNC(=O)[C@@]12C

InChI

InChI=1S/C11H16N2O3/c1-3-16-9(14)7-5-4-6-8-11(7,2)10(15)13-12-8/h7H,3-6H2,1-2H3,(H,13,15)/t7-,11+/m1/s1