1-(2-isothiocyanato-3-methyl-phenyl)piperidine

Systemtic Name: 1-(2-isothiocyanato-3-methyl-phenyl)piperidine Openeye Name: 1-(2-isothiocyanato-3-methyl-phenyl)piperidine CAS Name: 1-(2-isothiocyanato-3-methylphenyl)piperidine IUPAC Name: 1-(2-isothiocyanato-3-methylphenyl)piperidine Traditional Name: 1-(2-isothiocyanato-3-methyl-phenyl)piperidine Formula: C13H16N2S MolecularWeight: 232.34454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCCCC2)N=C=S

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCCCC2)N=C=S

InChI

InChI=1S/C13H16N2S/c1-11-6-5-7-12(13(11)14-10-16)15-8-3-2-4-9-15/h5-7H,2-4,8-9H2,1H3