O1-propan-2-yl O3-prop-1-en-2-yl (2E)-2-[4-(1-oxidanyl-1-pyrrolidin-1-yl-ethoxy)-1,3-dithiolan-2-ylidene]propanedioate

Systemtic Name: O1-propan-2-yl O3-prop-1-en-2-yl (2E)-2-[4-(1-oxidanyl-1-pyrrolidin-1-yl-ethoxy)-1,3-dithiolan-2-ylidene]propanedioate Openeye Name: O1-isopropenyl O3-isopropyl (2E)-2-[4-(1-hydroxy-1-pyrrolidin-1-yl-ethoxy)-1,3-dithiolan-2-ylidene]propanedioate CAS Name: (2E)-2-[4-[1-hydroxy-1-(1-pyrrolidinyl)ethoxy]-1,3-dithiolan-2-ylidene]propanedioic acid O1-(1-methylethenyl) ester O3-propan-2-yl ester IUPAC Name: 1-O-propan-2-yl 3-O-prop-1-en-2-yl (2E)-2-[4-(1-hydroxy-1-pyrrolidin-1-ylethoxy)-1,3-dithiolan-2-ylidene]propanedioate Traditional Name: (2E)-2-[4-(1-hydroxy-1-pyrrolidino-ethoxy)-1,3-dithiolan-2-ylidene]malonic acid O1-isopropenyl ester O3-isopropyl ester Formula: C18H27NO6S2 MolecularWeight: 417.54008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(=C1SCC(S1)OC(C)(N2CCCC2)O)C(=O)OC(=C)C

Isomeric SMILES

CC(C)OC(=O)/C(=C\1/SCC(S1)OC(C)(N2CCCC2)O)/C(=O)OC(=C)C

InChI

InChI=1S/C18H27NO6S2/c1-11(2)23-15(20)14(16(21)24-12(3)4)17-26-10-13(27-17)25-18(5,22)19-8-6-7-9-19/h12-13,22H,1,6-10H2,2-5H3/b17-14-