3-azido-2-[2-(phenylcarbonyloxy)phenyl]propanoic acid

Systemtic Name: 3-azido-2-[2-(phenylcarbonyloxy)phenyl]propanoic acid Openeye Name: 3-azido-2-(2-benzoyloxyphenyl)propanoic acid CAS Name: 3-azido-2-(2-benzoyloxyphenyl)propanoic acid IUPAC Name: 3-azido-2-(2-benzoyloxyphenyl)propanoic acid Traditional Name: 3-azido-2-(2-benzoyloxyphenyl)propionic acid Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C(CN=[N+]=[N-])C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C(CN=[N+]=[N-])C(=O)O

InChI

InChI=1S/C16H13N3O4/c17-19-18-10-13(15(20)21)12-8-4-5-9-14(12)23-16(22)11-6-2-1-3-7-11/h1-9,13H,10H2,(H,20,21)