5-(3-chloranyl-5-methyl-phenyl)sulfonyl-3-nitro-benzene-1,2-diol

Systemtic Name: 5-(3-chloranyl-5-methyl-phenyl)sulfonyl-3-nitro-benzene-1,2-diol Openeye Name: 5-(3-chloro-5-methyl-phenyl)sulfonyl-3-nitro-benzene-1,2-diol CAS Name: 5-(3-chloro-5-methylphenyl)sulfonyl-3-nitrobenzene-1,2-diol IUPAC Name: 5-(3-chloro-5-methylphenyl)sulfonyl-3-nitrobenzene-1,2-diol Traditional Name: 5-(3-chloro-5-methyl-phenyl)sulfonyl-3-nitro-pyrocatechol Formula: C13H10ClNO6S MolecularWeight: 343.7396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)Cl)S(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])O)O

Isomeric SMILES

CC1=CC(=CC(=C1)Cl)S(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])O)O

InChI

InChI=1S/C13H10ClNO6S/c1-7-2-8(14)4-9(3-7)22(20,21)10-5-11(15(18)19)13(17)12(16)6-10/h2-6,16-17H,1H3