N-(6-cyanonaphthalen-2-yl)carbamate; 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: N-(6-cyanonaphthalen-2-yl)carbamate; 2,2,2-tris(fluoranyl)ethanoate Openeye Name: N-(6-cyano-2-naphthyl)carbamate; 2,2,2-trifluoroacetate CAS Name: N-(6-cyano-2-naphthalenyl)carbamate; 2,2,2-trifluoroacetate IUPAC Name: N-(6-cyanonaphthalen-2-yl)carbamate; 2,2,2-trifluoroacetate Traditional Name: N-(6-cyano-2-naphthyl)carbamate; 2,2,2-trifluoroacetate Formula: C14H7F3N2O4-2 MolecularWeight: 324.21159

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)NC(=O)[O-])C=C1C#N.C(=O)(C(F)(F)F)[O-]

Isomeric SMILES

C1=CC2=C(C=CC(=C2)NC(=O)[O-])C=C1C#N.C(=O)(C(F)(F)F)[O-]

InChI

InChI=1S/C12H8N2O2.C2HF3O2/c13-7-8-1-2-10-6-11(14-12(15)16)4-3-9(10)5-8;3-2(4,5)1(6)7/h1-6,14H,(H,15,16);(H,6,7)/p-2