2-(4-nitro-1,3-benzoxazol-2-yl)ethanenitrile

Systemtic Name: 2-(4-nitro-1,3-benzoxazol-2-yl)ethanenitrile Openeye Name: 2-(4-nitro-1,3-benzoxazol-2-yl)acetonitrile CAS Name: 2-(4-nitro-1,3-benzoxazol-2-yl)acetonitrile IUPAC Name: 2-(4-nitro-1,3-benzoxazol-2-yl)acetonitrile Traditional Name: 2-(4-nitro-1,3-benzoxazol-2-yl)acetonitrile Formula: C9H5N3O3 MolecularWeight: 203.1543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)OC(=N2)CC#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C2C(=C1)OC(=N2)CC#N)[N+](=O)[O-]

InChI

InChI=1S/C9H5N3O3/c10-5-4-8-11-9-6(12(13)14)2-1-3-7(9)15-8/h1-3H,4H2