methyl 3-(4-oxidanylidenecyclohexa-2,5-dien-1-yl)propanoate

Systemtic Name: methyl 3-(4-oxidanylidenecyclohexa-2,5-dien-1-yl)propanoate Openeye Name: methyl 3-(4-oxocyclohexa-2,5-dien-1-yl)propanoate CAS Name: 3-(4-oxo-1-cyclohexa-2,5-dienyl)propanoic acid methyl ester IUPAC Name: methyl 3-(4-oxocyclohexa-2,5-dien-1-yl)propanoate Traditional Name: 3-(4-ketocyclohexa-2,5-dien-1-yl)propionic acid methyl ester Formula: C10H12O3 MolecularWeight: 180.20048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1C=CC(=O)C=C1

Isomeric SMILES

COC(=O)CCC1C=CC(=O)C=C1

InChI

InChI=1S/C10H12O3/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-3,5-6,8H,4,7H2,1H3