3-(pyridin-4-ylamino)-1,2-benzoxazol-7-ol hydrate hydrobromide

Systemtic Name: 3-(pyridin-4-ylamino)-1,2-benzoxazol-7-ol hydrate hydrobromide Openeye Name: 3-(4-pyridylamino)-1,2-benzoxazol-7-ol hydrate hydrobromide CAS Name: 3-(pyridin-4-ylamino)-1,2-benzoxazol-7-ol hydrate hydrobromide IUPAC Name: 3-(pyridin-4-ylamino)-1,2-benzoxazol-7-ol hydrate hydrobromide Traditional Name: 3-(4-pyridylamino)indoxazen-7-ol hydrate hydrobromide Formula: C12H12BrN3O3 MolecularWeight: 326.14598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)O)ON=C2NC3=CC=NC=C3.O.Br

Isomeric SMILES

C1=CC2=C(C(=C1)O)ON=C2NC3=CC=NC=C3.O.Br

InChI

InChI=1S/C12H9N3O2.BrH.H2O/c16-10-3-1-2-9-11(10)17-15-12(9)14-8-4-6-13-7-5-8;;/h1-7,16H,(H,13,14,15);1H;1H2