[(2S)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 2,6-dimethoxybenzoate

Systemtic Name: [(2S)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 2,6-dimethoxybenzoate Openeye Name: [(1S)-2-(2,5-dimethylphenyl)-1-methyl-2-oxo-ethyl] 2,6-dimethoxybenzoate CAS Name: 2,6-dimethoxybenzoic acid [(2S)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl] 2,6-dimethoxybenzoate Traditional Name: 2,6-dimethoxybenzoic acid [(1S)-2-(2,5-dimethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C20H22O5 MolecularWeight: 342.38568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)C(C)OC(=O)C2=C(C=CC=C2OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)[C@H](C)OC(=O)C2=C(C=CC=C2OC)OC

InChI

InChI=1S/C20H22O5/c1-12-9-10-13(2)15(11-12)19(21)14(3)25-20(22)18-16(23-4)7-6-8-17(18)24-5/h6-11,14H,1-5H3/t14-/m0/s1