methyl (1S,4S,6S)-6-(3,4-dimethoxyphenyl)-4-oxidanyl-cyclohex-2-ene-1-carboxylate

Systemtic Name: methyl (1S,4S,6S)-6-(3,4-dimethoxyphenyl)-4-oxidanyl-cyclohex-2-ene-1-carboxylate Openeye Name: methyl (1S,4S,6S)-6-(3,4-dimethoxyphenyl)-4-hydroxy-cyclohex-2-ene-1-carboxylate CAS Name: (1S,4S,6S)-6-(3,4-dimethoxyphenyl)-4-hydroxy-1-cyclohex-2-enecarboxylic acid methyl ester IUPAC Name: methyl (1S,4S,6S)-6-(3,4-dimethoxyphenyl)-4-hydroxycyclohex-2-ene-1-carboxylate Traditional Name: (1S,4S,6S)-6-(3,4-dimethoxyphenyl)-4-hydroxy-cyclohex-2-ene-1-carboxylic acid methyl ester Formula: C16H20O5 MolecularWeight: 292.327

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(C=CC2C(=O)OC)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H]2C[C@@H](C=C[C@@H]2C(=O)OC)O)OC

InChI

InChI=1S/C16H20O5/c1-19-14-7-4-10(8-15(14)20-2)13-9-11(17)5-6-12(13)16(18)21-3/h4-8,11-13,17H,9H2,1-3H3/t11-,12+,13-/m1/s1