methyl (1S,4S,6S)-6-(7-methoxy-1,3-benzodioxol-5-yl)-4-oxidanyl-cyclohex-2-ene-1-carboxylate

Systemtic Name: methyl (1S,4S,6S)-6-(7-methoxy-1,3-benzodioxol-5-yl)-4-oxidanyl-cyclohex-2-ene-1-carboxylate Openeye Name: methyl (1S,4S,6S)-4-hydroxy-6-(7-methoxy-1,3-benzodioxol-5-yl)cyclohex-2-ene-1-carboxylate CAS Name: (1S,4S,6S)-4-hydroxy-6-(7-methoxy-1,3-benzodioxol-5-yl)-1-cyclohex-2-enecarboxylic acid methyl ester IUPAC Name: methyl (1S,4S,6S)-4-hydroxy-6-(7-methoxy-1,3-benzodioxol-5-yl)cyclohex-2-ene-1-carboxylate Traditional Name: (1S,4S,6S)-4-hydroxy-6-(7-methoxy-1,3-benzodioxol-5-yl)cyclohex-2-ene-1-carboxylic acid methyl ester Formula: C16H18O6 MolecularWeight: 306.31052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C3CC(C=CC3C(=O)OC)O

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)[C@H]3C[C@@H](C=C[C@@H]3C(=O)OC)O

InChI

InChI=1S/C16H18O6/c1-19-13-5-9(6-14-15(13)22-8-21-14)12-7-10(17)3-4-11(12)16(18)20-2/h3-6,10-12,17H,7-8H2,1-2H3/t10-,11+,12-/m1/s1