2-(5-methoxy-7-nitro-1H-indol-3-yl)ethanenitrile

Systemtic Name: 2-(5-methoxy-7-nitro-1H-indol-3-yl)ethanenitrile Openeye Name: 2-(5-methoxy-7-nitro-1H-indol-3-yl)acetonitrile CAS Name: 2-(5-methoxy-7-nitro-1H-indol-3-yl)acetonitrile IUPAC Name: 2-(5-methoxy-7-nitro-1H-indol-3-yl)acetonitrile Traditional Name: 2-(5-methoxy-7-nitro-1H-indol-3-yl)acetonitrile Formula: C11H9N3O3 MolecularWeight: 231.20746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)C(=CN2)CC#N)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C2C(=C1)C(=CN2)CC#N)[N+](=O)[O-]

InChI

InChI=1S/C11H9N3O3/c1-17-8-4-9-7(2-3-12)6-13-11(9)10(5-8)14(15)16/h4-6,13H,2H2,1H3