2-[3-(azidomethyl)-4-oxidanyl-phenyl]propanedioic acid

Systemtic Name: 2-[3-(azidomethyl)-4-oxidanyl-phenyl]propanedioic acid Openeye Name: 2-[3-(azidomethyl)-4-hydroxy-phenyl]propanedioic acid CAS Name: 2-[3-(azidomethyl)-4-hydroxyphenyl]propanedioic acid IUPAC Name: 2-[3-(azidomethyl)-4-hydroxyphenyl]propanedioic acid Traditional Name: 2-[3-(azidomethyl)-4-hydroxy-phenyl]malonic acid Formula: C10H9N3O5 MolecularWeight: 251.19556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(C(=O)O)C(=O)O)CN=[N+]=[N-])O

Isomeric SMILES

C1=CC(=C(C=C1C(C(=O)O)C(=O)O)CN=[N+]=[N-])O

InChI

InChI=1S/C10H9N3O5/c11-13-12-4-6-3-5(1-2-7(6)14)8(9(15)16)10(17)18/h1-3,8,14H,4H2,(H,15,16)(H,17,18)