[4-[diazo-(2,4-dimethylphenyl)sulfonyl-methyl]sulfonylphenyl] ethanoate

Systemtic Name: [4-[diazo-(2,4-dimethylphenyl)sulfonyl-methyl]sulfonylphenyl] ethanoate Openeye Name: [4-[diazo-(2,4-dimethylphenyl)sulfonyl-methyl]sulfonylphenyl] acetate CAS Name: acetic acid [4-[diazo-(2,4-dimethylphenyl)sulfonylmethyl]sulfonylphenyl] ester IUPAC Name: [4-[diazo-(2,4-dimethylphenyl)sulfonylmethyl]sulfonylphenyl] acetate Traditional Name: acetic acid [4-[diazo-(2,4-dimethylphenyl)sulfonyl-methyl]sulfonylphenyl] ester Formula: C17H16N2O6S2 MolecularWeight: 408.44874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2=CC=C(C=C2)OC(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2=CC=C(C=C2)OC(=O)C)C

InChI

InChI=1S/C17H16N2O6S2/c1-11-4-9-16(12(2)10-11)27(23,24)17(19-18)26(21,22)15-7-5-14(6-8-15)25-13(3)20/h4-10H,1-3H3