propyl (5S,6R)-5,6-bis(oxidanyl)cyclohexa-1,3-diene-1-carboxylate

Systemtic Name: propyl (5S,6R)-5,6-bis(oxidanyl)cyclohexa-1,3-diene-1-carboxylate Openeye Name: propyl (5S,6R)-5,6-dihydroxycyclohexa-1,3-diene-1-carboxylate CAS Name: (5S,6R)-5,6-dihydroxy-1-cyclohexa-1,3-dienecarboxylic acid propyl ester IUPAC Name: propyl (5S,6R)-5,6-dihydroxycyclohexa-1,3-diene-1-carboxylate Traditional Name: (5S,6R)-5,6-dihydroxycyclohexa-1,3-diene-1-carboxylic acid propyl ester Formula: C10H14O4 MolecularWeight: 198.21576

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=CC(C1O)O

Isomeric SMILES

CCCOC(=O)C1=CC=C[C@@H]([C@@H]1O)O

InChI

InChI=1S/C10H14O4/c1-2-6-14-10(13)7-4-3-5-8(11)9(7)12/h3-5,8-9,11-12H,2,6H2,1H3/t8-,9+/m0/s1