[4-[(4-butanoyloxyphenyl)sulfonyl-diazo-methyl]sulfonylphenyl] butanoate

Systemtic Name: [4-[(4-butanoyloxyphenyl)sulfonyl-diazo-methyl]sulfonylphenyl] butanoate Openeye Name: [4-[(4-butanoyloxyphenyl)sulfonyl-diazo-methyl]sulfonylphenyl] butanoate CAS Name: butanoic acid [4-[diazo-[4-(1-oxobutoxy)phenyl]sulfonylmethyl]sulfonylphenyl] ester IUPAC Name: [4-[(4-butanoyloxyphenyl)sulfonyl-diazomethyl]sulfonylphenyl] butanoate Traditional Name: butyric acid [4-[(4-butyryloxyphenyl)sulfonyl-diazo-methyl]sulfonylphenyl] ester Formula: C21H22N2O8S2 MolecularWeight: 494.53798

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC=C(C=C1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2=CC=C(C=C2)OC(=O)CCC

Isomeric SMILES

CCCC(=O)OC1=CC=C(C=C1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2=CC=C(C=C2)OC(=O)CCC

InChI

InChI=1S/C21H22N2O8S2/c1-3-5-19(24)30-15-7-11-17(12-8-15)32(26,27)21(23-22)33(28,29)18-13-9-16(10-14-18)31-20(25)6-4-2/h7-14H,3-6H2,1-2H3