2-[(5S,6R)-5,6-bis(oxidanyl)cyclohexa-1,3-dien-1-yl]ethyl ethanoate

Systemtic Name: 2-[(5S,6R)-5,6-bis(oxidanyl)cyclohexa-1,3-dien-1-yl]ethyl ethanoate Openeye Name: 2-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dien-1-yl]ethyl acetate CAS Name: acetic acid 2-[(5S,6R)-5,6-dihydroxy-1-cyclohexa-1,3-dienyl]ethyl ester IUPAC Name: 2-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dien-1-yl]ethyl acetate Traditional Name: acetic acid 2-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dien-1-yl]ethyl ester Formula: C10H14O4 MolecularWeight: 198.21576

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCC1=CC=CC(C1O)O

Isomeric SMILES

CC(=O)OCCC1=CC=C[C@@H]([C@@H]1O)O

InChI

InChI=1S/C10H14O4/c1-7(11)14-6-5-8-3-2-4-9(12)10(8)13/h2-4,9-10,12-13H,5-6H2,1H3/t9-,10+/m0/s1