6-bromanyl-3-[(pyridin-2-ylamino)methyl]-1,3-benzoxazol-2-one

Systemtic Name: 6-bromanyl-3-[(pyridin-2-ylamino)methyl]-1,3-benzoxazol-2-one Openeye Name: 6-bromo-3-[(2-pyridylamino)methyl]-1,3-benzoxazol-2-one CAS Name: 6-bromo-3-[(2-pyridinylamino)methyl]-1,3-benzoxazol-2-one IUPAC Name: 6-bromo-3-[(pyridin-2-ylamino)methyl]-1,3-benzoxazol-2-one Traditional Name: 6-bromo-3-[(2-pyridylamino)methyl]-1,3-benzoxazol-2-one Formula: C13H10BrN3O2 MolecularWeight: 320.1414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NCN2C3=C(C=C(C=C3)Br)OC2=O

Isomeric SMILES

C1=CC=NC(=C1)NCN2C3=C(C=C(C=C3)Br)OC2=O

InChI

InChI=1S/C13H10BrN3O2/c14-9-4-5-10-11(7-9)19-13(18)17(10)8-16-12-3-1-2-6-15-12/h1-7H,8H2,(H,15,16)