2-(4-nitrosulfanylphenoxy)terephthalic acid

Systemtic Name: 2-(4-nitrosulfanylphenoxy)terephthalic acid Openeye Name: 2-(4-nitrosulfanylphenoxy)terephthalic acid CAS Name: 2-[4-(nitrothio)phenoxy]terephthalic acid IUPAC Name: 2-(4-nitrosulfanylphenoxy)terephthalic acid Traditional Name: 2-[4-(nitrothio)phenoxy]terephthalic acid Formula: C14H9NO7S MolecularWeight: 335.28876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC2=C(C=CC(=C2)C(=O)O)C(=O)O)S[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1OC2=C(C=CC(=C2)C(=O)O)C(=O)O)S[N+](=O)[O-]

InChI

InChI=1S/C14H9NO7S/c16-13(17)8-1-6-11(14(18)19)12(7-8)22-9-2-4-10(5-3-9)23-15(20)21/h1-7H,(H,16,17)(H,18,19)