methyl (1S,4S,5R)-5-(3,4-dimethoxyphenyl)-4-oxidanyl-cyclohex-2-ene-1-carboxylate

Systemtic Name: methyl (1S,4S,5R)-5-(3,4-dimethoxyphenyl)-4-oxidanyl-cyclohex-2-ene-1-carboxylate Openeye Name: methyl (1S,4S,5R)-5-(3,4-dimethoxyphenyl)-4-hydroxy-cyclohex-2-ene-1-carboxylate CAS Name: (1S,4S,5R)-5-(3,4-dimethoxyphenyl)-4-hydroxy-1-cyclohex-2-enecarboxylic acid methyl ester IUPAC Name: methyl (1S,4S,5R)-5-(3,4-dimethoxyphenyl)-4-hydroxycyclohex-2-ene-1-carboxylate Traditional Name: (1S,4S,5R)-5-(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=CC2O)C(=O)OC)OC

Isomeric SMILES

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

InChI

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