2-[2-azanyl-4-(1,3-benzoxazol-2-yl)phenyl]ethanenitrile

Systemtic Name: 2-[2-azanyl-4-(1,3-benzoxazol-2-yl)phenyl]ethanenitrile Openeye Name: 2-[2-amino-4-(1,3-benzoxazol-2-yl)phenyl]acetonitrile CAS Name: 2-[2-amino-4-(1,3-benzoxazol-2-yl)phenyl]acetonitrile IUPAC Name: 2-[2-amino-4-(1,3-benzoxazol-2-yl)phenyl]acetonitrile Traditional Name: 2-[2-amino-4-(1,3-benzoxazol-2-yl)phenyl]acetonitrile Formula: C15H11N3O MolecularWeight: 249.26734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)C3=CC(=C(C=C3)CC#N)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)C3=CC(=C(C=C3)CC#N)N

InChI

InChI=1S/C15H11N3O/c16-8-7-10-5-6-11(9-12(10)17)15-18-13-3-1-2-4-14(13)19-15/h1-6,9H,7,17H2