1-[(4-chlorophenyl)methylsulfanyl]-3-heptoxy-propan-2-ol

Systemtic Name: 1-[(4-chlorophenyl)methylsulfanyl]-3-heptoxy-propan-2-ol Openeye Name: 1-[(4-chlorophenyl)methylsulfanyl]-3-heptoxy-propan-2-ol CAS Name: 1-[(4-chlorophenyl)methylthio]-3-heptoxy-2-propanol IUPAC Name: 1-[(4-chlorophenyl)methylsulfanyl]-3-heptoxypropan-2-ol Traditional Name: 1-[(4-chlorobenzyl)thio]-3-heptoxy-propan-2-ol Formula: C17H27ClO2S MolecularWeight: 330.91308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOCC(CSCC1=CC=C(C=C1)Cl)O

Isomeric SMILES

CCCCCCCOCC(CSCC1=CC=C(C=C1)Cl)O

InChI

InChI=1S/C17H27ClO2S/c1-2-3-4-5-6-11-20-12-17(19)14-21-13-15-7-9-16(18)10-8-15/h7-10,17,19H,2-6,11-14H2,1H3