2-(diethylaminomethyl)-6-(3-octylsulfanylpropyl)phenol

Systemtic Name: 2-(diethylaminomethyl)-6-(3-octylsulfanylpropyl)phenol Openeye Name: 2-(diethylaminomethyl)-6-(3-octylsulfanylpropyl)phenol CAS Name: 2-(diethylaminomethyl)-6-[3-(octylthio)propyl]phenol IUPAC Name: 2-(diethylaminomethyl)-6-(3-octylsulfanylpropyl)phenol Traditional Name: 2-(diethylaminomethyl)-6-[3-(octylthio)propyl]phenol Formula: C22H39NOS MolecularWeight: 365.61616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSCCCC1=C(C(=CC=C1)CN(CC)CC)O

Isomeric SMILES

CCCCCCCCSCCCC1=C(C(=CC=C1)CN(CC)CC)O

InChI

InChI=1S/C22H39NOS/c1-4-7-8-9-10-11-17-25-18-13-16-20-14-12-15-21(22(20)24)19-23(5-2)6-3/h12,14-15,24H,4-11,13,16-19H2,1-3H3