ethyl 3,5-bis(oxidanyl)-4-[(Z)-1-oxidanylbut-1-enyl]cyclohexa-2,4-diene-1-carboxylate

Systemtic Name: ethyl 3,5-bis(oxidanyl)-4-[(Z)-1-oxidanylbut-1-enyl]cyclohexa-2,4-diene-1-carboxylate Openeye Name: ethyl 3,5-dihydroxy-4-[(Z)-1-hydroxybut-1-enyl]cyclohexa-2,4-diene-1-carboxylate CAS Name: 3,5-dihydroxy-4-[(Z)-1-hydroxybut-1-enyl]-1-cyclohexa-2,4-dienecarboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dihydroxy-4-[(Z)-1-hydroxybut-1-enyl]cyclohexa-2,4-diene-1-carboxylate Traditional Name: 3,5-dihydroxy-4-[(Z)-1-hydroxybut-1-enyl]cyclohexa-2,4-diene-1-carboxylic acid ethyl ester Formula: C13H18O5 MolecularWeight: 254.27902

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C1=C(CC(C=C1O)C(=O)OCC)O)O

Isomeric SMILES

CC/C=C(/C1=C(CC(C=C1O)C(=O)OCC)O)\O

InChI

InChI=1S/C13H18O5/c1-3-5-9(14)12-10(15)6-8(7-11(12)16)13(17)18-4-2/h5-6,8,14-16H,3-4,7H2,1-2H3/b9-5-