2,2-dimethyl-5-[2-(2-methylsulfonyl-5-thiophen-3-ylcarbonyl-pyrrol-1-yl)ethyl]-1,3-dioxane-4,6-dione

Systemtic Name: 2,2-dimethyl-5-[2-(2-methylsulfonyl-5-thiophen-3-ylcarbonyl-pyrrol-1-yl)ethyl]-1,3-dioxane-4,6-dione Openeye Name: 2,2-dimethyl-5-[2-[2-methylsulfonyl-5-(thiophene-3-carbonyl)pyrrol-1-yl]ethyl]-1,3-dioxane-4,6-dione CAS Name: 2,2-dimethyl-5-[2-[2-methylsulfonyl-5-[oxo(3-thiophenyl)methyl]-1-pyrrolyl]ethyl]-1,3-dioxane-4,6-dione IUPAC Name: 2,2-dimethyl-5-[2-[2-methylsulfonyl-5-(thiophene-3-carbonyl)pyrrol-1-yl]ethyl]-1,3-dioxane-4,6-dione Traditional Name: 5-[2-[2-mesyl-5-(3-thenoyl)pyrrol-1-yl]ethyl]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C18H19NO7S2 MolecularWeight: 425.47596

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)CCN2C(=CC=C2S(=O)(=O)C)C(=O)C3=CSC=C3)C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)CCN2C(=CC=C2S(=O)(=O)C)C(=O)C3=CSC=C3)C

InChI

InChI=1S/C18H19NO7S2/c1-18(2)25-16(21)12(17(22)26-18)6-8-19-13(4-5-14(19)28(3,23)24)15(20)11-7-9-27-10-11/h4-5,7,9-10,12H,6,8H2,1-3H3