7-chloranyl-4-methoxy-7-thiophen-2-ylsulfonyl-heptan-2-one

Systemtic Name: 7-chloranyl-4-methoxy-7-thiophen-2-ylsulfonyl-heptan-2-one Openeye Name: 7-chloro-4-methoxy-7-(2-thienylsulfonyl)heptan-2-one CAS Name: 7-chloro-4-methoxy-7-thiophen-2-ylsulfonyl-2-heptanone IUPAC Name: 7-chloro-4-methoxy-7-thiophen-2-ylsulfonylheptan-2-one Traditional Name: 7-chloro-4-methoxy-7-(2-thienylsulfonyl)heptan-2-one Formula: C12H17ClO4S2 MolecularWeight: 324.84398

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(CCC(S(=O)(=O)C1=CC=CS1)Cl)OC

Isomeric SMILES

CC(=O)CC(CCC(S(=O)(=O)C1=CC=CS1)Cl)OC

InChI

InChI=1S/C12H17ClO4S2/c1-9(14)8-10(17-2)5-6-11(13)19(15,16)12-4-3-7-18-12/h3-4,7,10-11H,5-6,8H2,1-2H3