2-(dimethylaminomethyl)-4-methyl-6-(3-octylsulfanylpropyl)phenol

Systemtic Name: 2-(dimethylaminomethyl)-4-methyl-6-(3-octylsulfanylpropyl)phenol Openeye Name: 2-(dimethylaminomethyl)-4-methyl-6-(3-octylsulfanylpropyl)phenol CAS Name: 2-(dimethylaminomethyl)-4-methyl-6-[3-(octylthio)propyl]phenol IUPAC Name: 2-(dimethylaminomethyl)-4-methyl-6-(3-octylsulfanylpropyl)phenol Traditional Name: 2-(dimethylaminomethyl)-4-methyl-6-[3-(octylthio)propyl]phenol Formula: C21H37NOS MolecularWeight: 351.58958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H37NOS/c1-5-6-7-8-9-10-13-24-14-11-12-19-15-18(2)16-20(21(19)23)17-22(3)4/h15-16,23H,5-14,17H2,1-4H3