5-(4-chloranylsulfonyl-2,3,6-trimethyl-phenoxy)pentanoic acid

Systemtic Name: 5-(4-chloranylsulfonyl-2,3,6-trimethyl-phenoxy)pentanoic acid Openeye Name: 5-(4-chlorosulfonyl-2,3,6-trimethyl-phenoxy)pentanoic acid CAS Name: 5-(4-chlorosulfonyl-2,3,6-trimethylphenoxy)pentanoic acid IUPAC Name: 5-(4-chlorosulfonyl-2,3,6-trimethylphenoxy)pentanoic acid Traditional Name: 5-(4-chlorosulfonyl-2,3,6-trimethyl-phenoxy)valeric acid Formula: C14H19ClO5S MolecularWeight: 334.81566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1OCCCCC(=O)O)C)C)S(=O)(=O)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1OCCCCC(=O)O)C)C)S(=O)(=O)Cl

InChI

InChI=1S/C14H19ClO5S/c1-9-8-12(21(15,18)19)10(2)11(3)14(9)20-7-5-4-6-13(16)17/h8H,4-7H2,1-3H3,(H,16,17)