1-[7-(3-azanylpropyl)-6-bromanyl-2-ethyl-2H-1,3-benzoxazol-3-yl]ethanone

Systemtic Name: 1-[7-(3-azanylpropyl)-6-bromanyl-2-ethyl-2H-1,3-benzoxazol-3-yl]ethanone Openeye Name: 1-[7-(3-aminopropyl)-6-bromo-2-ethyl-2H-1,3-benzoxazol-3-yl]ethanone CAS Name: 1-[7-(3-aminopropyl)-6-bromo-2-ethyl-2H-1,3-benzoxazol-3-yl]ethanone IUPAC Name: 1-[7-(3-aminopropyl)-6-bromo-2-ethyl-2H-1,3-benzoxazol-3-yl]ethanone Traditional Name: 1-[7-(3-aminopropyl)-6-bromo-2-ethyl-2H-1,3-benzoxazol-3-yl]ethanone Formula: C14H19BrN2O2 MolecularWeight: 327.21686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1N(C2=C(O1)C(=C(C=C2)Br)CCCN)C(=O)C

Isomeric SMILES

CCC1N(C2=C(O1)C(=C(C=C2)Br)CCCN)C(=O)C

InChI

InChI=1S/C14H19BrN2O2/c1-3-13-17(9(2)18)12-7-6-11(15)10(5-4-8-16)14(12)19-13/h6-7,13H,3-5,8,16H2,1-2H3