3-[1,3-benzoxazol-2-yl(ethylamino)amino]propanenitrile

Systemtic Name: 3-[1,3-benzoxazol-2-yl(ethylamino)amino]propanenitrile Openeye Name: 3-[1,3-benzoxazol-2-yl(ethylamino)amino]propanenitrile CAS Name: 3-[1,3-benzoxazol-2-yl(ethylamino)amino]propanenitrile IUPAC Name: 3-[1,3-benzoxazol-2-yl(ethylamino)amino]propanenitrile Traditional Name: 3-[1,3-benzoxazol-2-yl(ethylamino)amino]propionitrile Formula: C12H14N4O MolecularWeight: 230.26576

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Descriptors Computed from Structure

Canonical SMILES:

CCNN(CCC#N)C1=NC2=CC=CC=C2O1

Isomeric SMILES

CCNN(CCC#N)C1=NC2=CC=CC=C2O1

InChI

InChI=1S/C12H14N4O/c1-2-14-16(9-5-8-13)12-15-10-6-3-4-7-11(10)17-12/h3-4,6-7,14H,2,5,9H2,1H3