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

Systemtic Name: 5-[2-(2-chloranyl-5-thiophen-3-ylcarbonyl-pyrrol-1-yl)ethyl]-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-[2-[2-chloro-5-(thiophene-3-carbonyl)pyrrol-1-yl]ethyl]-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-[2-[2-chloro-5-[oxo(3-thiophenyl)methyl]-1-pyrrolyl]ethyl]-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[2-[2-chloro-5-(thiophene-3-carbonyl)pyrrol-1-yl]ethyl]-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-[2-[2-chloro-5-(3-thenoyl)pyrrol-1-yl]ethyl]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C17H16ClNO5S MolecularWeight: 381.83064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)CCN2C(=CC=C2Cl)C(=O)C3=CSC=C3)C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)CCN2C(=CC=C2Cl)C(=O)C3=CSC=C3)C

InChI

InChI=1S/C17H16ClNO5S/c1-17(2)23-15(21)11(16(22)24-17)5-7-19-12(3-4-13(19)18)14(20)10-6-8-25-9-10/h3-4,6,8-9,11H,5,7H2,1-2H3