3-[azanyl(benzo[e][1,3]benzoxazol-2-yl)amino]propanenitrile

Systemtic Name: 3-[azanyl(benzo[e][1,3]benzoxazol-2-yl)amino]propanenitrile Openeye Name: 3-[amino(benzo[e][1,3]benzoxazol-2-yl)amino]propanenitrile CAS Name: 3-[amino(2-benzo[e][1,3]benzoxazolyl)amino]propanenitrile IUPAC Name: 3-[amino(benzo[e][1,3]benzoxazol-2-yl)amino]propanenitrile Traditional Name: 3-[amino(benzo[e][1,3]benzoxazol-2-yl)amino]propionitrile Formula: C14H12N4O MolecularWeight: 252.27128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2N=C(O3)N(CCC#N)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2N=C(O3)N(CCC#N)N

InChI

InChI=1S/C14H12N4O/c15-8-3-9-18(16)14-17-13-11-5-2-1-4-10(11)6-7-12(13)19-14/h1-2,4-7H,3,9,16H2