methyl (3R,3aR)-3,7-dimethyl-6-oxidanylidene-2,3,4,5-tetrahydro-1H-indene-3a-carboxylate

Systemtic Name: methyl (3R,3aR)-3,7-dimethyl-6-oxidanylidene-2,3,4,5-tetrahydro-1H-indene-3a-carboxylate Openeye Name: methyl (3R,3aR)-3,7-dimethyl-6-oxo-2,3,4,5-tetrahydro-1H-indene-3a-carboxylate CAS Name: (3R,3aR)-3,7-dimethyl-6-oxo-2,3,4,5-tetrahydro-1H-indene-3a-carboxylic acid methyl ester IUPAC Name: methyl (3R,3aR)-3,7-dimethyl-6-oxo-2,3,4,5-tetrahydro-1H-indene-3a-carboxylate Traditional Name: (3R,3aR)-6-keto-3,7-dimethyl-2,3,4,5-tetrahydro-1H-indene-3a-carboxylic acid methyl ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C(=O)CCC12C(=O)OC)C

Isomeric SMILES

C[C@@H]1CCC2=C(C(=O)CC[C@@]12C(=O)OC)C

InChI

InChI=1S/C13H18O3/c1-8-4-5-10-9(2)11(14)6-7-13(8,10)12(15)16-3/h8H,4-7H2,1-3H3/t8-,13-/m1/s1