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

Systemtic Name: 3-(5-bromanylthiophen-2-yl)-4,5,6,7-tetrahydro-2H-[1,2]oxazolo[5,4-b]azepine Openeye Name: 3-(5-bromo-2-thienyl)-4,5,6,7-tetrahydro-2H-isoxazolo[5,4-b]azepine CAS Name: 3-(5-bromo-2-thiophenyl)-4,5,6,7-tetrahydro-2H-isoxazolo[5,4-b]azepine IUPAC Name: 3-(5-bromothiophen-2-yl)-4,5,6,7-tetrahydro-2H-[1,2]oxazolo[5,4-b]azepine Traditional Name: 3-(5-bromo-2-thienyl)-4,5,6,7-tetrahydro-2H-isoxazol[5,4-b]azepine Formula: C11H11BrN2OS MolecularWeight: 299.18684

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN=C2C(=C(NO2)C3=CC=C(S3)Br)C1

Isomeric SMILES

C1CCN=C2C(=C(NO2)C3=CC=C(S3)Br)C1

InChI

InChI=1S/C11H11BrN2OS/c12-9-5-4-8(16-9)10-7-3-1-2-6-13-11(7)15-14-10/h4-5,14H,1-3,6H2