1-[diazo-(4-heptylcyclohexyl)sulfonyl-methyl]sulfonyl-2,4-dimethyl-benzene

Systemtic Name: 1-[diazo-(4-heptylcyclohexyl)sulfonyl-methyl]sulfonyl-2,4-dimethyl-benzene Openeye Name: 1-[diazo-(4-heptylcyclohexyl)sulfonyl-methyl]sulfonyl-2,4-dimethyl-benzene CAS Name: 1-[diazo-(4-heptylcyclohexyl)sulfonylmethyl]sulfonyl-2,4-dimethylbenzene IUPAC Name: 1-[diazo-(4-heptylcyclohexyl)sulfonylmethyl]sulfonyl-2,4-dimethylbenzene Traditional Name: 1-[diazo-(4-heptylcyclohexyl)sulfonyl-methyl]sulfonyl-2,4-dimethyl-benzene Formula: C22H34N2O4S2 MolecularWeight: 454.64636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2=C(C=C(C=C2)C)C

Isomeric SMILES

CCCCCCCC1CCC(CC1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2=C(C=C(C=C2)C)C

InChI

InChI=1S/C22H34N2O4S2/c1-4-5-6-7-8-9-19-11-13-20(14-12-19)29(25,26)22(24-23)30(27,28)21-15-10-17(2)16-18(21)3/h10,15-16,19-20H,4-9,11-14H2,1-3H3