4-[diazo-(2-methylphenyl)sulfonyl-methyl]sulfonyl-1,2-dihexoxy-benzene

Systemtic Name: 4-[diazo-(2-methylphenyl)sulfonyl-methyl]sulfonyl-1,2-dihexoxy-benzene Openeye Name: 4-[diazo(o-tolylsulfonyl)methyl]sulfonyl-1,2-dihexoxy-benzene CAS Name: 4-[diazo-(2-methylphenyl)sulfonylmethyl]sulfonyl-1,2-dihexoxybenzene IUPAC Name: 4-[diazo-(2-methylphenyl)sulfonylmethyl]sulfonyl-1,2-dihexoxybenzene Traditional Name: 4-[diazo(o-tolylsulfonyl)methyl]sulfonyl-1,2-dihexoxy-benzene Formula: C26H36N2O6S2 MolecularWeight: 536.70384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2=CC=CC=C2C)OCCCCCC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2=CC=CC=C2C)OCCCCCC

InChI

InChI=1S/C26H36N2O6S2/c1-4-6-8-12-18-33-23-17-16-22(20-24(23)34-19-13-9-7-5-2)35(29,30)26(28-27)36(31,32)25-15-11-10-14-21(25)3/h10-11,14-17,20H,4-9,12-13,18-19H2,1-3H3