methyl (4aS)-4a-methyl-2-oxidanylidene-3,4,5,6,7,8-hexahydronaphthalene-1-carboxylate

Systemtic Name: methyl (4aS)-4a-methyl-2-oxidanylidene-3,4,5,6,7,8-hexahydronaphthalene-1-carboxylate Openeye Name: methyl (4aS)-4a-methyl-2-oxo-3,4,5,6,7,8-hexahydronaphthalene-1-carboxylate CAS Name: (4aS)-4a-methyl-2-oxo-3,4,5,6,7,8-hexahydronaphthalene-1-carboxylic acid methyl ester IUPAC Name: methyl (4aS)-4a-methyl-2-oxo-3,4,5,6,7,8-hexahydronaphthalene-1-carboxylate Traditional Name: (4aS)-2-keto-4a-methyl-3,4,5,6,7,8-hexahydronaphthalene-1-carboxylic acid methyl ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCCCC1=C(C(=O)CC2)C(=O)OC

Isomeric SMILES

C[C@@]12CCCCC1=C(C(=O)CC2)C(=O)OC

InChI

InChI=1S/C13H18O3/c1-13-7-4-3-5-9(13)11(12(15)16-2)10(14)6-8-13/h3-8H2,1-2H3/t13-/m0/s1