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

Systemtic Name: 1-[diazo-(4-hexylcyclohexyl)sulfonyl-methyl]sulfonyl-2,4-dimethyl-benzene Openeye Name: 1-[diazo-(4-hexylcyclohexyl)sulfonyl-methyl]sulfonyl-2,4-dimethyl-benzene CAS Name: 1-[diazo-(4-hexylcyclohexyl)sulfonylmethyl]sulfonyl-2,4-dimethylbenzene IUPAC Name: 1-[diazo-(4-hexylcyclohexyl)sulfonylmethyl]sulfonyl-2,4-dimethylbenzene Traditional Name: 1-[diazo-(4-hexylcyclohexyl)sulfonyl-methyl]sulfonyl-2,4-dimethyl-benzene Formula: C21H32N2O4S2 MolecularWeight: 440.61978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2=C(C=C(C=C2)C)C

Isomeric SMILES

CCCCCCC1CCC(CC1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2=C(C=C(C=C2)C)C

InChI

InChI=1S/C21H32N2O4S2/c1-4-5-6-7-8-18-10-12-19(13-11-18)28(24,25)21(23-22)29(26,27)20-14-9-16(2)15-17(20)3/h9,14-15,18-19H,4-8,10-13H2,1-3H3