(4,5,6,7-tetradeuterio-1,2-benzoxazol-3-yl)methanesulfonyl chloride

Systemtic Name: (4,5,6,7-tetradeuterio-1,2-benzoxazol-3-yl)methanesulfonyl chloride Openeye Name: (4,5,6,7-tetradeuterio-1,2-benzoxazol-3-yl)methanesulfonyl chloride CAS Name: (4,5,6,7-tetradeuterio-1,2-benzoxazol-3-yl)methanesulfonyl chloride IUPAC Name: (4,5,6,7-tetradeuterio-1,2-benzoxazol-3-yl)methanesulfonyl chloride Traditional Name: (4,5,6,7-tetradeuterioindoxazen-3-yl)methanesulfonyl chloride Formula: C8H6ClNO3S MolecularWeight: 235.680787

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NO2)CS(=O)(=O)Cl

Isomeric SMILES

[2H]C1=C(C(=C2C(=C1[2H])C(=NO2)CS(=O)(=O)Cl)[2H])[2H]

InChI

InChI=1S/C8H6ClNO3S/c9-14(11,12)5-7-6-3-1-2-4-8(6)13-10-7/h1-4H,5H2/i1D,2D,3D,4D