phenyl 2-methoxy-4-nitro-benzenesulfonate

Systemtic Name: phenyl 2-methoxy-4-nitro-benzenesulfonate Openeye Name: phenyl 2-methoxy-4-nitro-benzenesulfonate CAS Name: 2-methoxy-4-nitrobenzenesulfonic acid phenyl ester IUPAC Name: phenyl 2-methoxy-4-nitrobenzenesulfonate Traditional Name: 2-methoxy-4-nitro-benzenesulfonic acid phenyl ester Formula: C13H11NO6S MolecularWeight: 309.29454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC=CC=C2

InChI

InChI=1S/C13H11NO6S/c1-19-12-9-10(14(15)16)7-8-13(12)21(17,18)20-11-5-3-2-4-6-11/h2-9H,1H3