hydroxymethyl 2-butyl-5-oxidanylidene-cyclopent-3-ene-1-carboxylate

Systemtic Name: hydroxymethyl 2-butyl-5-oxidanylidene-cyclopent-3-ene-1-carboxylate Openeye Name: hydroxymethyl 2-butyl-5-oxo-cyclopent-3-ene-1-carboxylate CAS Name: 2-butyl-5-oxo-1-cyclopent-3-enecarboxylic acid hydroxymethyl ester IUPAC Name: hydroxymethyl 2-butyl-5-oxocyclopent-3-ene-1-carboxylate Traditional Name: 2-butyl-5-keto-cyclopent-3-ene-1-carboxylic acid methylol ester Formula: C11H16O4 MolecularWeight: 212.24234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C=CC(=O)C1C(=O)OCO

Isomeric SMILES

CCCCC1C=CC(=O)C1C(=O)OCO

InChI

InChI=1S/C11H16O4/c1-2-3-4-8-5-6-9(13)10(8)11(14)15-7-12/h5-6,8,10,12H,2-4,7H2,1H3