5-[azanyl(1,3-benzoxazol-2-yl)amino]pentanenitrile

Systemtic Name: 5-[azanyl(1,3-benzoxazol-2-yl)amino]pentanenitrile Openeye Name: 5-[amino(1,3-benzoxazol-2-yl)amino]pentanenitrile CAS Name: 5-[amino(1,3-benzoxazol-2-yl)amino]pentanenitrile IUPAC Name: 5-[amino(1,3-benzoxazol-2-yl)amino]pentanenitrile Traditional Name: 5-[amino(1,3-benzoxazol-2-yl)amino]valeronitrile Formula: C12H14N4O MolecularWeight: 230.26576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)N(CCCCC#N)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)N(CCCCC#N)N

InChI

InChI=1S/C12H14N4O/c13-8-4-1-5-9-16(14)12-15-10-6-2-3-7-11(10)17-12/h2-3,6-7H,1,4-5,9,14H2