ethyl (1S,3aR)-1-methyl-3-oxidanylidene-1H-cyclohepta[c]furan-3a-carboxylate

Systemtic Name: ethyl (1S,3aR)-1-methyl-3-oxidanylidene-1H-cyclohepta[c]furan-3a-carboxylate Openeye Name: ethyl (1S,3aR)-1-methyl-3-oxo-1H-cyclohepta[c]furan-3a-carboxylate CAS Name: (1S,3aR)-1-methyl-3-oxo-1H-cyclohepta[c]furan-3a-carboxylic acid ethyl ester IUPAC Name: ethyl (1S,3aR)-1-methyl-3-oxo-1H-cyclohepta[c]furan-3a-carboxylate Traditional Name: (1S,3aR)-3-keto-1-methyl-1H-cyclohepta[c]furan-3a-carboxylic acid ethyl ester Formula: C13H14O4 MolecularWeight: 234.24786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C12C=CC=CC=C1C(OC2=O)C

Isomeric SMILES

CCOC(=O)[C@@]12C=CC=CC=C1[C@@H](OC2=O)C

InChI

InChI=1S/C13H14O4/c1-3-16-11(14)13-8-6-4-5-7-10(13)9(2)17-12(13)15/h4-9H,3H2,1-2H3/t9-,13+/m0/s1