2-chloranyloxirane; (3,3-dimethyl-2H-1-benzofuran-5-yl)methylsulfamic acid

Systemtic Name: 2-chloranyloxirane; (3,3-dimethyl-2H-1-benzofuran-5-yl)methylsulfamic acid Openeye Name: 2-chlorooxirane; (3,3-dimethyl-2H-benzofuran-5-yl)methylsulfamic acid CAS Name: 2-chlorooxirane; (3,3-dimethyl-2H-benzofuran-5-yl)methylsulfamic acid IUPAC Name: 2-chlorooxirane; (3,3-dimethyl-2H-1-benzofuran-5-yl)methylsulfamic acid Traditional Name: 2-chlorooxirane; (3,3-dimethylcoumaran-5-yl)methylsulfamic acid Formula: C13H18ClNO5S MolecularWeight: 335.80372

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C1C=C(C=C2)CNS(=O)(=O)O)C.C1C(O1)Cl

Isomeric SMILES

CC1(COC2=C1C=C(C=C2)CNS(=O)(=O)O)C.C1C(O1)Cl

InChI

InChI=1S/C11H15NO4S.C2H3ClO/c1-11(2)7-16-10-4-3-8(5-9(10)11)6-12-17(13,14)15;3-2-1-4-2/h3-5,12H,6-7H2,1-2H3,(H,13,14,15);2H,1H2