2-[2-(4-nitrophenyl)sulfanylphenyl]ethanoic acid

Systemtic Name: 2-[2-(4-nitrophenyl)sulfanylphenyl]ethanoic acid Openeye Name: 2-[2-(4-nitrophenyl)sulfanylphenyl]acetic acid CAS Name: 2-[2-[(4-nitrophenyl)thio]phenyl]acetic acid IUPAC Name: 2-[2-(4-nitrophenyl)sulfanylphenyl]acetic acid Traditional Name: 2-[2-[(4-nitrophenyl)thio]phenyl]acetic acid Formula: C14H11NO4S MolecularWeight: 289.30644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11NO4S/c16-14(17)9-10-3-1-2-4-13(10)20-12-7-5-11(6-8-12)15(18)19/h1-8H,9H2,(H,16,17)