methyl 2,4-bis[(2-nitrophenyl)sulfonyloxy]butanoate

Systemtic Name: methyl 2,4-bis[(2-nitrophenyl)sulfonyloxy]butanoate Openeye Name: methyl 2,4-bis[(2-nitrophenyl)sulfonyloxy]butanoate CAS Name: 2,4-bis[(2-nitrophenyl)sulfonyloxy]butanoic acid methyl ester IUPAC Name: methyl 2,4-bis[(2-nitrophenyl)sulfonyloxy]butanoate Traditional Name: 2,4-bis[(2-nitrophenyl)sulfonyloxy]butyric acid methyl ester Formula: C17H16N2O12S2 MolecularWeight: 504.44514

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCOS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-])OS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(CCOS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-])OS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O12S2/c1-29-17(20)14(31-33(27,28)16-9-5-3-7-13(16)19(23)24)10-11-30-32(25,26)15-8-4-2-6-12(15)18(21)22/h2-9,14H,10-11H2,1H3