2-(4-bromanyl-2-nitro-phenyl)sulfanylbenzoate

Systemtic Name: 2-(4-bromanyl-2-nitro-phenyl)sulfanylbenzoate Openeye Name: 2-(4-bromo-2-nitro-phenyl)sulfanylbenzoate CAS Name: 2-[(4-bromo-2-nitrophenyl)thio]benzoate IUPAC Name: 2-(4-bromo-2-nitrophenyl)sulfanylbenzoate Traditional Name: 2-[(4-bromo-2-nitro-phenyl)thio]benzoate Formula: C13H7BrNO4S- MolecularWeight: 353.16798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])SC2=C(C=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])SC2=C(C=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C13H8BrNO4S/c14-8-5-6-12(10(7-8)15(18)19)20-11-4-2-1-3-9(11)13(16)17/h1-7H,(H,16,17)/p-1