2-[diazo-(5-methyl-2-octoxy-phenyl)sulfonyl-methyl]sulfonyl-4-methyl-1-octoxy-benzene

Systemtic Name: 2-[diazo-(5-methyl-2-octoxy-phenyl)sulfonyl-methyl]sulfonyl-4-methyl-1-octoxy-benzene Openeye Name: 2-[diazo-(5-methyl-2-octoxy-phenyl)sulfonyl-methyl]sulfonyl-4-methyl-1-octoxy-benzene CAS Name: 2-[diazo-(5-methyl-2-octoxyphenyl)sulfonylmethyl]sulfonyl-4-methyl-1-octoxybenzene IUPAC Name: 2-[diazo-(5-methyl-2-octoxyphenyl)sulfonylmethyl]sulfonyl-4-methyl-1-octoxybenzene Traditional Name: 2-[diazo-(5-methyl-2-octoxy-phenyl)sulfonyl-methyl]sulfonyl-4-methyl-1-octoxy-benzene Formula: C31H46N2O6S2 MolecularWeight: 606.83674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2=C(C=CC(=C2)C)OCCCCCCCC

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2=C(C=CC(=C2)C)OCCCCCCCC

InChI

InChI=1S/C31H46N2O6S2/c1-5-7-9-11-13-15-21-38-27-19-17-25(3)23-29(27)40(34,35)31(33-32)41(36,37)30-24-26(4)18-20-28(30)39-22-16-14-12-10-8-6-2/h17-20,23-24H,5-16,21-22H2,1-4H3