4-[3-(azidomethyl)phenyl]-2,4-bis(oxidanylidene)butanoic acid

Systemtic Name: 4-[3-(azidomethyl)phenyl]-2,4-bis(oxidanylidene)butanoic acid Openeye Name: 4-[3-(azidomethyl)phenyl]-2,4-dioxo-butanoic acid CAS Name: 4-[3-(azidomethyl)phenyl]-2,4-dioxobutanoic acid IUPAC Name: 4-[3-(azidomethyl)phenyl]-2,4-dioxobutanoic acid Traditional Name: 4-[3-(azidomethyl)phenyl]-2,4-diketo-butyric acid Formula: C11H9N3O4 MolecularWeight: 247.20686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9N3O4/c12-14-13-6-7-2-1-3-8(4-7)9(15)5-10(16)11(17)18/h1-4H,5-6H2,(H,17,18)