3-pyridin-3-yl-6,7,8,8a-tetrahydro-5H-[1,2]oxazolo[5,4-b]azepine

Systemtic Name: 3-pyridin-3-yl-6,7,8,8a-tetrahydro-5H-[1,2]oxazolo[5,4-b]azepine Openeye Name: 3-(3-pyridyl)-6,7,8,8a-tetrahydro-5H-isoxazolo[5,4-b]azepine CAS Name: 3-(3-pyridinyl)-6,7,8,8a-tetrahydro-5H-isoxazolo[5,4-b]azepine IUPAC Name: 3-pyridin-3-yl-6,7,8,8a-tetrahydro-5H-[1,2]oxazolo[5,4-b]azepine Traditional Name: 3-(3-pyridyl)-6,7,8,8a-tetrahydro-5H-isoxazol[5,4-b]azepine Formula: C12H13N3O MolecularWeight: 215.25112

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C2C(NC1)ON=C2C3=CN=CC=C3

Isomeric SMILES

C1CC=C2C(NC1)ON=C2C3=CN=CC=C3

InChI

InChI=1S/C12H13N3O/c1-2-7-14-12-10(5-1)11(15-16-12)9-4-3-6-13-8-9/h3-6,8,12,14H,1-2,7H2