4-azanyl-2-oxidanyl-benzoic acid; 5-pyridin-4-yl-3H-1,3,4-oxadiazol-2-one

Systemtic Name: 4-azanyl-2-oxidanyl-benzoic acid; 5-pyridin-4-yl-3H-1,3,4-oxadiazol-2-one Openeye Name: 4-amino-2-hydroxy-benzoic acid; 5-(4-pyridyl)-3H-1,3,4-oxadiazol-2-one CAS Name: 4-amino-2-hydroxybenzoic acid; 5-pyridin-4-yl-3H-1,3,4-oxadiazol-2-one IUPAC Name: 4-amino-2-hydroxybenzoic acid; 5-pyridin-4-yl-3H-1,3,4-oxadiazol-2-one Traditional Name: 4-amino-2-hydroxy-benzoic acid; 5-(4-pyridyl)-3H-1,3,4-oxadiazol-2-one Formula: C14H12N4O5 MolecularWeight: 316.26888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)O)C(=O)O.C1=CN=CC=C1C2=NNC(=O)O2

Isomeric SMILES

C1=CC(=C(C=C1N)O)C(=O)O.C1=CN=CC=C1C2=NNC(=O)O2

InChI

InChI=1S/C7H5N3O2.C7H7NO3/c11-7-10-9-6(12-7)5-1-3-8-4-2-5;8-4-1-2-5(7(10)11)6(9)3-4/h1-4H,(H,10,11);1-3,9H,8H2,(H,10,11)