2-[7-methoxy-3,4-bis(oxidanylidene)naphthalen-1-yl]ethanenitrile

Systemtic Name: 2-[7-methoxy-3,4-bis(oxidanylidene)naphthalen-1-yl]ethanenitrile Openeye Name: 2-(7-methoxy-3,4-dioxo-1-naphthyl)acetonitrile CAS Name: 2-(7-methoxy-3,4-dioxo-1-naphthalenyl)acetonitrile IUPAC Name: 2-(7-methoxy-3,4-dioxonaphthalen-1-yl)acetonitrile Traditional Name: 2-(3,4-diketo-7-methoxy-1-naphthyl)acetonitrile Formula: C13H9NO3 MolecularWeight: 227.21546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)C(=O)C=C2CC#N

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)C(=O)C=C2CC#N

InChI

InChI=1S/C13H9NO3/c1-17-9-2-3-10-11(7-9)8(4-5-14)6-12(15)13(10)16/h2-3,6-7H,4H2,1H3