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

Systemtic Name: 2-[2-(4-nitrophenyl)ethylsulfanyl]ethanoic acid Openeye Name: 2-[2-(4-nitrophenyl)ethylsulfanyl]acetic acid CAS Name: 2-[2-(4-nitrophenyl)ethylthio]acetic acid IUPAC Name: 2-[2-(4-nitrophenyl)ethylsulfanyl]acetic acid Traditional Name: 2-[2-(4-nitrophenyl)ethylthio]acetic acid Formula: C10H11NO4S MolecularWeight: 241.26364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCSCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CCSCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C10H11NO4S/c12-10(13)7-16-6-5-8-1-3-9(4-2-8)11(14)15/h1-4H,5-7H2,(H,12,13)