[3-(4-chloranyl-3,5-dimethyl-phenoxy)-2-oxidanyl-propyl]-ethyl-sulfamic acid

Systemtic Name: [3-(4-chloranyl-3,5-dimethyl-phenoxy)-2-oxidanyl-propyl]-ethyl-sulfamic acid Openeye Name: [3-(4-chloro-3,5-dimethyl-phenoxy)-2-hydroxy-propyl]-ethyl-sulfamic acid CAS Name: [3-(4-chloro-3,5-dimethylphenoxy)-2-hydroxypropyl]-ethylsulfamic acid IUPAC Name: [3-(4-chloro-3,5-dimethylphenoxy)-2-hydroxypropyl]-ethylsulfamic acid Traditional Name: [3-(4-chloro-3,5-dimethyl-phenoxy)-2-hydroxy-propyl]-ethyl-sulfamic acid Formula: C13H20ClNO5S MolecularWeight: 337.8196

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(COC1=CC(=C(C(=C1)C)Cl)C)O)S(=O)(=O)O

Isomeric SMILES

CCN(CC(COC1=CC(=C(C(=C1)C)Cl)C)O)S(=O)(=O)O

InChI

InChI=1S/C13H20ClNO5S/c1-4-15(21(17,18)19)7-11(16)8-20-12-5-9(2)13(14)10(3)6-12/h5-6,11,16H,4,7-8H2,1-3H3,(H,17,18,19)