methyl 2-[2-(2-methoxy-2-oxidanylidene-ethyl)-4-(1-methoxy-1-oxidanylidene-propan-2-yl)phenyl]sulfanylbenzoate

Systemtic Name: methyl 2-[2-(2-methoxy-2-oxidanylidene-ethyl)-4-(1-methoxy-1-oxidanylidene-propan-2-yl)phenyl]sulfanylbenzoate Openeye Name: methyl 2-[4-(2-methoxy-1-methyl-2-oxo-ethyl)-2-(2-methoxy-2-oxo-ethyl)phenyl]sulfanylbenzoate CAS Name: 2-[[2-(2-methoxy-2-oxoethyl)-4-(1-methoxy-1-oxopropan-2-yl)phenyl]thio]benzoic acid methyl ester IUPAC Name: methyl 2-[2-(2-methoxy-2-oxoethyl)-4-(1-methoxy-1-oxopropan-2-yl)phenyl]sulfanylbenzoate Traditional Name: 2-[[2-(2-keto-2-methoxy-ethyl)-4-(2-keto-2-methoxy-1-methyl-ethyl)phenyl]thio]benzoic acid methyl ester Formula: C21H22O6S MolecularWeight: 402.46078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)SC2=CC=CC=C2C(=O)OC)CC(=O)OC)C(=O)OC

Isomeric SMILES

CC(C1=CC(=C(C=C1)SC2=CC=CC=C2C(=O)OC)CC(=O)OC)C(=O)OC

InChI

InChI=1S/C21H22O6S/c1-13(20(23)26-3)14-9-10-17(15(11-14)12-19(22)25-2)28-18-8-6-5-7-16(18)21(24)27-4/h5-11,13H,12H2,1-4H3