2-[diazo-(2,4-dimethylphenyl)sulfonyl-methyl]sulfonyl-1-hexoxy-4-methyl-benzene

Systemtic Name: 2-[diazo-(2,4-dimethylphenyl)sulfonyl-methyl]sulfonyl-1-hexoxy-4-methyl-benzene Openeye Name: 2-[diazo-(2,4-dimethylphenyl)sulfonyl-methyl]sulfonyl-1-hexoxy-4-methyl-benzene CAS Name: 2-[diazo-(2,4-dimethylphenyl)sulfonylmethyl]sulfonyl-1-hexoxy-4-methylbenzene IUPAC Name: 2-[diazo-(2,4-dimethylphenyl)sulfonylmethyl]sulfonyl-1-hexoxy-4-methylbenzene Traditional Name: 2-[diazo-(2,4-dimethylphenyl)sulfonyl-methyl]sulfonyl-1-hexoxy-4-methyl-benzene Formula: C22H28N2O5S2 MolecularWeight: 464.59812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2=C(C=C(C=C2)C)C

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2=C(C=C(C=C2)C)C

InChI

InChI=1S/C22H28N2O5S2/c1-5-6-7-8-13-29-19-11-9-17(3)15-21(19)31(27,28)22(24-23)30(25,26)20-12-10-16(2)14-18(20)4/h9-12,14-15H,5-8,13H2,1-4H3