methyl 6-[[4-(3-nitrophenyl)sulfonyloxyphenyl]carbonylamino]hexanoate

Systemtic Name: methyl 6-[[4-(3-nitrophenyl)sulfonyloxyphenyl]carbonylamino]hexanoate Openeye Name: methyl 6-[[4-(3-nitrophenyl)sulfonyloxybenzoyl]amino]hexanoate CAS Name: 6-[[[4-(3-nitrophenyl)sulfonyloxyphenyl]-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[4-(3-nitrophenyl)sulfonyloxybenzoyl]amino]hexanoate Traditional Name: 6-[[4-(3-nitrophenyl)sulfonyloxybenzoyl]amino]hexanoic acid methyl ester Formula: C20H22N2O8S MolecularWeight: 450.46228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O8S/c1-29-19(23)8-3-2-4-13-21-20(24)15-9-11-17(12-10-15)30-31(27,28)18-7-5-6-16(14-18)22(25)26/h5-7,9-12,14H,2-4,8,13H2,1H3,(H,21,24)