2-(5-fluoranyl-4-methyl-2-nitro-phenyl)sulfanylbenzoic acid

Systemtic Name: 2-(5-fluoranyl-4-methyl-2-nitro-phenyl)sulfanylbenzoic acid Openeye Name: 2-(5-fluoro-4-methyl-2-nitro-phenyl)sulfanylbenzoic acid CAS Name: 2-[(5-fluoro-4-methyl-2-nitrophenyl)thio]benzoic acid IUPAC Name: 2-(5-fluoro-4-methyl-2-nitrophenyl)sulfanylbenzoic acid Traditional Name: 2-[(5-fluoro-4-methyl-2-nitro-phenyl)thio]benzoic acid Formula: C14H10FNO4S MolecularWeight: 307.296903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1F)SC2=CC=CC=C2C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1F)SC2=CC=CC=C2C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H10FNO4S/c1-8-6-11(16(19)20)13(7-10(8)15)21-12-5-3-2-4-9(12)14(17)18/h2-7H,1H3,(H,17,18)