2-azanyl-3-[2-(2-nitrophenyl)sulfanylphenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[2-(2-nitrophenyl)sulfanylphenyl]propanoic acid Openeye Name: 2-amino-3-[2-(2-nitrophenyl)sulfanylphenyl]propanoic acid CAS Name: 2-amino-3-[2-[(2-nitrophenyl)thio]phenyl]propanoic acid IUPAC Name: 2-amino-3-[2-(2-nitrophenyl)sulfanylphenyl]propanoic acid Traditional Name: 2-amino-3-[2-[(2-nitrophenyl)thio]phenyl]propionic acid Formula: C15H14N2O4S MolecularWeight: 318.34766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N2O4S/c16-11(15(18)19)9-10-5-1-3-7-13(10)22-14-8-4-2-6-12(14)17(20)21/h1-8,11H,9,16H2,(H,18,19)