3-(2-nitrophenyl)propanethioic S-acid

Systemtic Name: 3-(2-nitrophenyl)propanethioic S-acid Openeye Name: 3-(2-nitrophenyl)propanethioic S-acid CAS Name: 3-(2-nitrophenyl)propanethioic S-acid IUPAC Name: 3-(2-nitrophenyl)propanethioic S-acid Traditional Name: 3-(2-nitrophenyl)thiopropionic acid Formula: C9H9NO3S MolecularWeight: 211.23766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO3S/c11-9(14)6-5-7-3-1-2-4-8(7)10(12)13/h1-4H,5-6H2,(H,11,14)