[3-methoxy-4-(propanoylamino)phenyl] thiocyanate

Systemtic Name: [3-methoxy-4-(propanoylamino)phenyl] thiocyanate Openeye Name: [3-methoxy-4-(propanoylamino)phenyl] thiocyanate CAS Name: thiocyanic acid [3-methoxy-4-(1-oxopropylamino)phenyl] ester IUPAC Name: [3-methoxy-4-(propanoylamino)phenyl] thiocyanate Traditional Name: thiocyanic acid (3-methoxy-4-propionamido-phenyl) ester Formula: C11H12N2O2S MolecularWeight: 236.29018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=C(C=C1)SC#N)OC

Isomeric SMILES

CCC(=O)NC1=C(C=C(C=C1)SC#N)OC

InChI

InChI=1S/C11H12N2O2S/c1-3-11(14)13-9-5-4-8(16-7-12)6-10(9)15-2/h4-6H,3H2,1-2H3,(H,13,14)