3-ethylnonan-3-yl thiocyanate

Systemtic Name: 3-ethylnonan-3-yl thiocyanate Openeye Name: 1,1-diethylheptyl thiocyanate CAS Name: thiocyanic acid 3-ethylnonan-3-yl ester IUPAC Name: 3-ethylnonan-3-yl thiocyanate Traditional Name: thiocyanic acid 1,1-diethylheptyl ester Formula: C12H23NS MolecularWeight: 213.38272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC)(CC)SC#N

Isomeric SMILES

CCCCCCC(CC)(CC)SC#N

InChI

InChI=1S/C12H23NS/c1-4-7-8-9-10-12(5-2,6-3)14-11-13/h4-10H2,1-3H3