(phenylmethyl) 2,3-diethyl-3-oxidanyl-5-oxidanylidene-cyclopentene-1-carboxylate

Systemtic Name: (phenylmethyl) 2,3-diethyl-3-oxidanyl-5-oxidanylidene-cyclopentene-1-carboxylate Openeye Name: benzyl 2,3-diethyl-3-hydroxy-5-oxo-cyclopentene-1-carboxylate CAS Name: 2,3-diethyl-3-hydroxy-5-oxo-1-cyclopentenecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2,3-diethyl-3-hydroxy-5-oxocyclopentene-1-carboxylate Traditional Name: 2,3-diethyl-3-hydroxy-5-keto-cyclopentene-1-carboxylic acid benzyl ester Formula: C17H20O4 MolecularWeight: 288.3383

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)CC1(CC)O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC1=C(C(=O)CC1(CC)O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H20O4/c1-3-13-15(14(18)10-17(13,20)4-2)16(19)21-11-12-8-6-5-7-9-12/h5-9,20H,3-4,10-11H2,1-2H3