dimethyl 2-[[1-prop-2-enoxycarbonyl-4-(triphenylmethyl)sulfanyl-pyrrolidin-2-yl]methyl]propanedioate

Systemtic Name: dimethyl 2-[[1-prop-2-enoxycarbonyl-4-(triphenylmethyl)sulfanyl-pyrrolidin-2-yl]methyl]propanedioate Openeye Name: dimethyl 2-[(1-allyloxycarbonyl-4-tritylsulfanyl-pyrrolidin-2-yl)methyl]propanedioate CAS Name: 2-[[1-[oxo(prop-2-enoxy)methyl]-4-[(triphenylmethyl)thio]-2-pyrrolidinyl]methyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(1-prop-2-enoxycarbonyl-4-tritylsulfanylpyrrolidin-2-yl)methyl]propanedioate Traditional Name: 2-[[1-allyloxycarbonyl-4-(tritylthio)pyrrolidin-2-yl]methyl]malonic acid dimethyl ester Formula: C33H35NO6S MolecularWeight: 573.6991

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1CC(CN1C(=O)OCC=C)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

COC(=O)C(CC1CC(CN1C(=O)OCC=C)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C33H35NO6S/c1-4-20-40-32(37)34-23-28(21-27(34)22-29(30(35)38-2)31(36)39-3)41-33(24-14-8-5-9-15-24,25-16-10-6-11-17-25)26-18-12-7-13-19-26/h4-19,27-29H,1,20-23H2,2-3H3