3-[4-(3-nitrophenyl)phenyl]sulfanylpropanoic acid

Systemtic Name: 3-[4-(3-nitrophenyl)phenyl]sulfanylpropanoic acid Openeye Name: 3-[4-(3-nitrophenyl)phenyl]sulfanylpropanoic acid CAS Name: 3-[[4-(3-nitrophenyl)phenyl]thio]propanoic acid IUPAC Name: 3-[4-(3-nitrophenyl)phenyl]sulfanylpropanoic acid Traditional Name: 3-[[4-(3-nitrophenyl)phenyl]thio]propionic acid Formula: C15H13NO4S MolecularWeight: 303.33302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13NO4S/c17-15(18)8-9-21-14-6-4-11(5-7-14)12-2-1-3-13(10-12)16(19)20/h1-7,10H,8-9H2,(H,17,18)