1-[diazo-(2-methylphenyl)sulfonyl-methyl]sulfonyl-2,3,4-trihexoxy-benzene

Systemtic Name: 1-[diazo-(2-methylphenyl)sulfonyl-methyl]sulfonyl-2,3,4-trihexoxy-benzene Openeye Name: 1-[diazo(o-tolylsulfonyl)methyl]sulfonyl-2,3,4-trihexoxy-benzene CAS Name: 1-[diazo-(2-methylphenyl)sulfonylmethyl]sulfonyl-2,3,4-trihexoxybenzene IUPAC Name: 1-[diazo-(2-methylphenyl)sulfonylmethyl]sulfonyl-2,3,4-trihexoxybenzene Traditional Name: 1-[diazo(o-tolylsulfonyl)methyl]sulfonyl-2,3,4-trihexoxy-benzene Formula: C32H48N2O7S2 MolecularWeight: 636.86272

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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)OCCCCCC

Isomeric SMILES

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

InChI

InChI=1S/C32H48N2O7S2/c1-5-8-11-16-23-39-27-21-22-29(31(41-25-18-13-10-7-3)30(27)40-24-17-12-9-6-2)43(37,38)32(34-33)42(35,36)28-20-15-14-19-26(28)4/h14-15,19-22H,5-13,16-18,23-25H2,1-4H3