diethyl 2-[2-[[3-[(4-ethoxy-3-ethoxycarbonyl-2-methyl-4-oxidanylidene-butan-2-yl)sulfinylmethyl]phenyl]methylsulfinyl]propan-2-yl]propanedioate

Systemtic Name: diethyl 2-[2-[[3-[(4-ethoxy-3-ethoxycarbonyl-2-methyl-4-oxidanylidene-butan-2-yl)sulfinylmethyl]phenyl]methylsulfinyl]propan-2-yl]propanedioate Openeye Name: diethyl 2-[1-[[3-[(3-ethoxy-2-ethoxycarbonyl-1,1-dimethyl-3-oxo-propyl)sulfinylmethyl]phenyl]methylsulfinyl]-1-methyl-ethyl]propanedioate CAS Name: 2-[2-[[3-[(4-ethoxy-3-ethoxycarbonyl-2-methyl-4-oxobutan-2-yl)sulfinylmethyl]phenyl]methylsulfinyl]propan-2-yl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[2-[[3-[(4-ethoxy-3-ethoxycarbonyl-2-methyl-4-oxobutan-2-yl)sulfinylmethyl]phenyl]methylsulfinyl]propan-2-yl]propanedioate Traditional Name: 2-[1-[3-[(2-carbethoxy-3-ethoxy-3-keto-1,1-dimethyl-propyl)sulfinylmethyl]benzyl]sulfinyl-1-methyl-ethyl]malonic acid diethyl ester Formula: C28H42O10S2 MolecularWeight: 602.75708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)C(C)(C)S(=O)CC1=CC(=CC=C1)CS(=O)C(C)(C)C(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)C(C)(C)S(=O)CC1=CC(=CC=C1)CS(=O)C(C)(C)C(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C28H42O10S2/c1-9-35-23(29)21(24(30)36-10-2)27(5,6)39(33)17-19-14-13-15-20(16-19)18-40(34)28(7,8)22(25(31)37-11-3)26(32)38-12-4/h13-16,21-22H,9-12,17-18H2,1-8H3