[4-[bis(oxidanyl)methyl]-5-(chloromethyl)-5-oxidanyl-3-prop-1-en-2-yl-cyclopent-2-en-1-yl] ethanoate

Systemtic Name: [4-[bis(oxidanyl)methyl]-5-(chloromethyl)-5-oxidanyl-3-prop-1-en-2-yl-cyclopent-2-en-1-yl] ethanoate Openeye Name: [5-(chloromethyl)-4-(dihydroxymethyl)-5-hydroxy-3-isopropenyl-cyclopent-2-en-1-yl] acetate CAS Name: acetic acid [5-(chloromethyl)-4-(dihydroxymethyl)-5-hydroxy-3-(1-methylethenyl)-1-cyclopent-2-enyl] ester IUPAC Name: [5-(chloromethyl)-4-(dihydroxymethyl)-5-hydroxy-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate Traditional Name: acetic acid [5-(chloromethyl)-4-(dihydroxymethyl)-5-hydroxy-3-isopropenyl-cyclopent-2-en-1-yl] ester Formula: C12H17ClO5 MolecularWeight: 276.71338

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=CC(C(C1C(O)O)(CCl)O)OC(=O)C

Isomeric SMILES

CC(=C)C1=CC(C(C1C(O)O)(CCl)O)OC(=O)C

InChI

InChI=1S/C12H17ClO5/c1-6(2)8-4-9(18-7(3)14)12(17,5-13)10(8)11(15)16/h4,9-11,15-17H,1,5H2,2-3H3