4-(4-hexylphenyl)-3-(3-triisothiocyanatosilylpropyl)phenol

Systemtic Name: 4-(4-hexylphenyl)-3-(3-triisothiocyanatosilylpropyl)phenol Openeye Name: 4-(4-hexylphenyl)-3-(3-triisothiocyanatosilylpropyl)phenol CAS Name: 4-(4-hexylphenyl)-3-(3-triisothiocyanatosilylpropyl)phenol IUPAC Name: 4-(4-hexylphenyl)-3-(3-triisothiocyanatosilylpropyl)phenol Traditional Name: 4-(4-hexylphenyl)-3-(3-triisothiocyanatosilylpropyl)phenol Formula: C24H27N3OS3Si MolecularWeight: 497.77118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=C(C=C(C=C2)O)CCC[Si](N=C=S)(N=C=S)N=C=S

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=C(C=C(C=C2)O)CCC[Si](N=C=S)(N=C=S)N=C=S

InChI

InChI=1S/C24H27N3OS3Si/c1-2-3-4-5-7-20-9-11-21(12-10-20)24-14-13-23(28)16-22(24)8-6-15-32(25-17-29,26-18-30)27-19-31/h9-14,16,28H,2-8,15H2,1H3