ethyl (1R,6aS)-2-acetyloxy-3-methyl-1,5,6,6a-tetrahydropentalene-1-carboxylate

Systemtic Name: ethyl (1R,6aS)-2-acetyloxy-3-methyl-1,5,6,6a-tetrahydropentalene-1-carboxylate Openeye Name: ethyl (1R,6aS)-2-acetoxy-3-methyl-1,5,6,6a-tetrahydropentalene-1-carboxylate CAS Name: (1R,6aS)-2-acetyloxy-3-methyl-1,5,6,6a-tetrahydropentalene-1-carboxylic acid ethyl ester IUPAC Name: ethyl (1R,6aS)-2-acetyloxy-3-methyl-1,5,6,6a-tetrahydropentalene-1-carboxylate Traditional Name: (1R,6aS)-2-acetoxy-3-methyl-1,5,6,6a-tetrahydropentalene-1-carboxylic acid ethyl ester Formula: C14H18O4 MolecularWeight: 250.29032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2CCC=C2C(=C1OC(=O)C)C

Isomeric SMILES

CCOC(=O)[C@@H]1[C@@H]2CCC=C2C(=C1OC(=O)C)C

InChI

InChI=1S/C14H18O4/c1-4-17-14(16)12-11-7-5-6-10(11)8(2)13(12)18-9(3)15/h6,11-12H,4-5,7H2,1-3H3/t11-,12-/m1/s1