methyl 4-chloranyl-3-nitro-benzenesulfonate

Systemtic Name: methyl 4-chloranyl-3-nitro-benzenesulfonate Openeye Name: methyl 4-chloro-3-nitro-benzenesulfonate CAS Name: 4-chloro-3-nitrobenzenesulfonic acid methyl ester IUPAC Name: methyl 4-chloro-3-nitrobenzenesulfonate Traditional Name: 4-chloro-3-nitro-benzenesulfonic acid methyl ester Formula: C7H6ClNO5S MolecularWeight: 251.64424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H6ClNO5S/c1-14-15(12,13)5-2-3-6(8)7(4-5)9(10)11/h2-4H,1H3