ethyl (3aS)-6-methyl-2-oxidanylidene-3a,4,5,6-tetrahydro-3H-pentalene-1-carboxylate

Systemtic Name: ethyl (3aS)-6-methyl-2-oxidanylidene-3a,4,5,6-tetrahydro-3H-pentalene-1-carboxylate Openeye Name: ethyl (3aS)-6-methyl-2-oxo-3a,4,5,6-tetrahydro-3H-pentalene-1-carboxylate CAS Name: (3aS)-6-methyl-2-oxo-3a,4,5,6-tetrahydro-3H-pentalene-1-carboxylic acid ethyl ester IUPAC Name: ethyl (3aS)-6-methyl-2-oxo-3a,4,5,6-tetrahydro-3H-pentalene-1-carboxylate Traditional Name: (3aS)-2-keto-6-methyl-3a,4,5,6-tetrahydro-3H-pentalene-1-carboxylic acid ethyl ester Formula: C12H16O3 MolecularWeight: 208.25364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(CCC2CC1=O)C

Isomeric SMILES

CCOC(=O)C1=C2[C@@H](CCC2C)CC1=O

InChI

InChI=1S/C12H16O3/c1-3-15-12(14)11-9(13)6-8-5-4-7(2)10(8)11/h7-8H,3-6H2,1-2H3/t7?,8-/m0/s1