4-(4-butoxyphenyl)-3-(3-triisothiocyanatosilylpropyl)phenol

Systemtic Name: 4-(4-butoxyphenyl)-3-(3-triisothiocyanatosilylpropyl)phenol Openeye Name: 4-(4-butoxyphenyl)-3-(3-triisothiocyanatosilylpropyl)phenol CAS Name: 4-(4-butoxyphenyl)-3-(3-triisothiocyanatosilylpropyl)phenol IUPAC Name: 4-(4-butoxyphenyl)-3-(3-triisothiocyanatosilylpropyl)phenol Traditional Name: 4-(4-butoxyphenyl)-3-(3-triisothiocyanatosilylpropyl)phenol Formula: C22H23N3O2S3Si MolecularWeight: 485.71742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=C(C=C(C=C2)O)CCC[Si](N=C=S)(N=C=S)N=C=S

Isomeric SMILES

CCCCOC1=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/C22H23N3O2S3Si/c1-2-3-12-27-21-9-6-18(7-10-21)22-11-8-20(26)14-19(22)5-4-13-31(23-15-28,24-16-29)25-17-30/h6-11,14,26H,2-5,12-13H2,1H3