5-nitro-2-(phenylsulfonyl)cyclohexa-2,4-dien-1-one

Systemtic Name: 5-nitro-2-(phenylsulfonyl)cyclohexa-2,4-dien-1-one Openeye Name: 2-(benzenesulfonyl)-5-nitro-cyclohexa-2,4-dien-1-one CAS Name: 2-(benzenesulfonyl)-5-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 2-(benzenesulfonyl)-5-nitrocyclohexa-2,4-dien-1-one Traditional Name: 2-besyl-5-nitro-cyclohexa-2,4-dien-1-one Formula: C12H9NO5S MolecularWeight: 279.26856

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC=C(C1=O)S(=O)(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1C(=CC=C(C1=O)S(=O)(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H9NO5S/c14-11-8-9(13(15)16)6-7-12(11)19(17,18)10-4-2-1-3-5-10/h1-7H,8H2