[(1S)-2-oxidanylidenecyclohexyl] 2,3,4-trimethoxybenzoate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 2,3,4-trimethoxybenzoate Openeye Name: [(1S)-2-oxocyclohexyl] 2,3,4-trimethoxybenzoate CAS Name: 2,3,4-trimethoxybenzoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 2,3,4-trimethoxybenzoate Traditional Name: 2,3,4-trimethoxybenzoic acid [(1S)-2-ketocyclohexyl] ester Formula: C16H20O6 MolecularWeight: 308.3264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)OC2CCCCC2=O)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)O[C@H]2CCCCC2=O)OC)OC

InChI

InChI=1S/C16H20O6/c1-19-13-9-8-10(14(20-2)15(13)21-3)16(18)22-12-7-5-4-6-11(12)17/h8-9,12H,4-7H2,1-3H3/t12-/m0/s1