[3,5-bis(dimethylaminomethyl)-4-oxidanyl-phenyl] thiocyanate

Systemtic Name: [3,5-bis(dimethylaminomethyl)-4-oxidanyl-phenyl] thiocyanate Openeye Name: [3,5-bis(dimethylaminomethyl)-4-hydroxy-phenyl] thiocyanate CAS Name: thiocyanic acid [3,5-bis(dimethylaminomethyl)-4-hydroxyphenyl] ester IUPAC Name: [3,5-bis(dimethylaminomethyl)-4-hydroxyphenyl] thiocyanate Traditional Name: thiocyanic acid [3,5-bis(dimethylaminomethyl)-4-hydroxy-phenyl] ester Formula: C13H19N3OS MolecularWeight: 265.37446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(=CC(=C1O)CN(C)C)SC#N

Isomeric SMILES

CN(C)CC1=CC(=CC(=C1O)CN(C)C)SC#N

InChI

InChI=1S/C13H19N3OS/c1-15(2)7-10-5-12(18-9-14)6-11(13(10)17)8-16(3)4/h5-6,17H,7-8H2,1-4H3