[2-oxidanylidene-2-(2,2,4-trimethylquinolin-1-yl)ethyl] thiocyanate

Systemtic Name: [2-oxidanylidene-2-(2,2,4-trimethylquinolin-1-yl)ethyl] thiocyanate Openeye Name: [2-oxo-2-(2,2,4-trimethyl-1-quinolyl)ethyl] thiocyanate CAS Name: thiocyanic acid [2-oxo-2-(2,2,4-trimethyl-1-quinolinyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,2,4-trimethylquinolin-1-yl)ethyl] thiocyanate Traditional Name: thiocyanic acid [2-keto-2-(2,2,4-trimethyl-1-quinolyl)ethyl] ester Formula: C15H16N2OS MolecularWeight: 272.36534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(C2=CC=CC=C12)C(=O)CSC#N)(C)C

Isomeric SMILES

CC1=CC(N(C2=CC=CC=C12)C(=O)CSC#N)(C)C

InChI

InChI=1S/C15H16N2OS/c1-11-8-15(2,3)17(14(18)9-19-10-16)13-7-5-4-6-12(11)13/h4-8H,9H2,1-3H3