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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN=C2C(=C(NO2)C3=CC=NC=C3)C1

Isomeric SMILES

C1CCN=C2C(=C(NO2)C3=CC=NC=C3)C1

InChI

InChI=1S/C12H13N3O/c1-2-6-14-12-10(3-1)11(15-16-12)9-4-7-13-8-5-9/h4-5,7-8,15H,1-3,6H2