(2E)-2-(6-methoxy-2,3-dimethyl-7-nitro-2,3-dihydroinden-1-ylidene)ethanenitrile

Systemtic Name: (2E)-2-(6-methoxy-2,3-dimethyl-7-nitro-2,3-dihydroinden-1-ylidene)ethanenitrile Openeye Name: (2E)-2-(6-methoxy-2,3-dimethyl-7-nitro-indan-1-ylidene)acetonitrile CAS Name: (2E)-2-(6-methoxy-2,3-dimethyl-7-nitro-2,3-dihydroinden-1-ylidene)acetonitrile IUPAC Name: (2E)-2-(6-methoxy-2,3-dimethyl-7-nitro-2,3-dihydroinden-1-ylidene)acetonitrile Traditional Name: (2E)-2-(6-methoxy-2,3-dimethyl-7-nitro-indan-1-ylidene)acetonitrile Formula: C14H14N2O3 MolecularWeight: 258.27256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=CC#N)C2=C1C=CC(=C2[N+](=O)[O-])OC)C

Isomeric SMILES

CC1C(/C(=C\C#N)/C2=C1C=CC(=C2[N+](=O)[O-])OC)C

InChI

InChI=1S/C14H14N2O3/c1-8-9(2)11(6-7-15)13-10(8)4-5-12(19-3)14(13)16(17)18/h4-6,8-9H,1-3H3/b11-6+