5-(2-chloranylsulfonyl-4-methyl-phenoxy)pentanoic acid

Systemtic Name: 5-(2-chloranylsulfonyl-4-methyl-phenoxy)pentanoic acid Openeye Name: 5-(2-chlorosulfonyl-4-methyl-phenoxy)pentanoic acid CAS Name: 5-(2-chlorosulfonyl-4-methylphenoxy)pentanoic acid IUPAC Name: 5-(2-chlorosulfonyl-4-methylphenoxy)pentanoic acid Traditional Name: 5-(2-chlorosulfonyl-4-methyl-phenoxy)valeric acid Formula: C12H15ClO5S MolecularWeight: 306.7625

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCCC(=O)O)S(=O)(=O)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCCC(=O)O)S(=O)(=O)Cl

InChI

InChI=1S/C12H15ClO5S/c1-9-5-6-10(11(8-9)19(13,16)17)18-7-3-2-4-12(14)15/h5-6,8H,2-4,7H2,1H3,(H,14,15)