2-(4-bromanyl-2-nitro-phenyl)propane-1-sulfinate

Systemtic Name: 2-(4-bromanyl-2-nitro-phenyl)propane-1-sulfinate Openeye Name: 2-(4-bromo-2-nitro-phenyl)propane-1-sulfinate CAS Name: 2-(4-bromo-2-nitrophenyl)-1-propanesulfinate IUPAC Name: 2-(4-bromo-2-nitrophenyl)propane-1-sulfinate Traditional Name: 2-(4-bromo-2-nitro-phenyl)propane-1-sulfinate Formula: C9H9BrNO4S- MolecularWeight: 307.14106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10BrNO4S/c1-6(5-16(14)15)8-3-2-7(10)4-9(8)11(12)13/h2-4,6H,5H2,1H3,(H,14,15)/p-1