5-[7-(fluoranylmethyl)-3-methoxy-5-nitro-naphthalen-1-yl]-4-methoxy-3-oxidanylidene-2-(trifluoromethyl)pentanenitrile

Systemtic Name: 5-[7-(fluoranylmethyl)-3-methoxy-5-nitro-naphthalen-1-yl]-4-methoxy-3-oxidanylidene-2-(trifluoromethyl)pentanenitrile Openeye Name: 5-[7-(fluoromethyl)-3-methoxy-5-nitro-1-naphthyl]-4-methoxy-3-oxo-2-(trifluoromethyl)pentanenitrile CAS Name: 5-[7-(fluoromethyl)-3-methoxy-5-nitro-1-naphthalenyl]-4-methoxy-3-oxo-2-(trifluoromethyl)pentanenitrile IUPAC Name: 5-[7-(fluoromethyl)-3-methoxy-5-nitronaphthalen-1-yl]-4-methoxy-3-oxo-2-(trifluoromethyl)pentanenitrile Traditional Name: 5-[7-(fluoromethyl)-3-methoxy-5-nitro-1-naphthyl]-3-keto-4-methoxy-2-(trifluoromethyl)valeronitrile Formula: C19H16F4N2O5 MolecularWeight: 428.334353

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C(C=C2C(=C1)CC(C(=O)C(C#N)C(F)(F)F)OC)CF)[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C(C=C2C(=C1)CC(C(=O)C(C#N)C(F)(F)F)OC)CF)[N+](=O)[O-]

InChI

InChI=1S/C19H16F4N2O5/c1-29-12-5-11(6-17(30-2)18(26)15(9-24)19(21,22)23)13-3-10(8-20)4-16(25(27)28)14(13)7-12/h3-5,7,15,17H,6,8H2,1-2H3