4-methoxy-2-nitro-6-(phenylsulfonylmethyl)phenol

Systemtic Name: 4-methoxy-2-nitro-6-(phenylsulfonylmethyl)phenol Openeye Name: 2-(benzenesulfonylmethyl)-4-methoxy-6-nitro-phenol CAS Name: 2-(benzenesulfonylmethyl)-4-methoxy-6-nitrophenol IUPAC Name: 2-(benzenesulfonylmethyl)-4-methoxy-6-nitrophenol Traditional Name: 2-(besylmethyl)-4-methoxy-6-nitro-phenol Formula: C14H13NO6S MolecularWeight: 323.32112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13NO6S/c1-21-11-7-10(14(16)13(8-11)15(17)18)9-22(19,20)12-5-3-2-4-6-12/h2-8,16H,9H2,1H3