[(2R)-1-(4-ethoxyphenyl)-1-oxidanylidene-propan-2-yl] 2,4,5-trimethoxybenzoate

Systemtic Name: [(2R)-1-(4-ethoxyphenyl)-1-oxidanylidene-propan-2-yl] 2,4,5-trimethoxybenzoate Openeye Name: [(1R)-2-(4-ethoxyphenyl)-1-methyl-2-oxo-ethyl] 2,4,5-trimethoxybenzoate CAS Name: 2,4,5-trimethoxybenzoic acid [(2R)-1-(4-ethoxyphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-ethoxyphenyl)-1-oxopropan-2-yl] 2,4,5-trimethoxybenzoate Traditional Name: 2,4,5-trimethoxybenzoic acid [(1R)-2-keto-1-methyl-2-p-phenetyl-ethyl] ester Formula: C21H24O7 MolecularWeight: 388.41106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC(=C(C=C2OC)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)[C@@H](C)OC(=O)C2=CC(=C(C=C2OC)OC)OC

InChI

InChI=1S/C21H24O7/c1-6-27-15-9-7-14(8-10-15)20(22)13(2)28-21(23)16-11-18(25-4)19(26-5)12-17(16)24-3/h7-13H,6H2,1-5H3/t13-/m1/s1