methyl 4-nitrobenzenesulfonate

Systemtic Name: methyl 4-nitrobenzenesulfonate Openeye Name: methyl 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid methyl ester IUPAC Name: methyl 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid methyl ester Formula: C7H7NO5S MolecularWeight: 217.19918

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

COS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C7H7NO5S/c1-13-14(11,12)7-4-2-6(3-5-7)8(9)10/h2-5H,1H3