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

Systemtic Name: 2-[diazo-(2,4-dimethylphenyl)sulfonyl-methyl]sulfonyl-4-methyl-1-pentoxy-benzene Openeye Name: 2-[diazo-(2,4-dimethylphenyl)sulfonyl-methyl]sulfonyl-4-methyl-1-pentoxy-benzene CAS Name: 2-[diazo-(2,4-dimethylphenyl)sulfonylmethyl]sulfonyl-4-methyl-1-pentoxybenzene IUPAC Name: 2-[diazo-(2,4-dimethylphenyl)sulfonylmethyl]sulfonyl-4-methyl-1-pentoxybenzene Traditional Name: 1-amoxy-2-[diazo-(2,4-dimethylphenyl)sulfonyl-methyl]sulfonyl-4-methyl-benzene Formula: C21H26N2O5S2 MolecularWeight: 450.57154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=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

CCCCCOC1=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/C21H26N2O5S2/c1-5-6-7-12-28-18-10-8-16(3)14-20(18)30(26,27)21(23-22)29(24,25)19-11-9-15(2)13-17(19)4/h8-11,13-14H,5-7,12H2,1-4H3