S-[1-(dimethylamino)ethyl] (E)-octadec-9-enethioate

Systemtic Name: S-[1-(dimethylamino)ethyl] (E)-octadec-9-enethioate Openeye Name: S-[1-(dimethylamino)ethyl] (E)-octadec-9-enethioate CAS Name: (E)-9-octadecenethioic acid S-[1-(dimethylamino)ethyl] ester IUPAC Name: S-[1-(dimethylamino)ethyl] (E)-octadec-9-enethioate Traditional Name: (E)-octadec-9-enethioic acid S-[1-(dimethylamino)ethyl] ester Formula: C22H43NOS MolecularWeight: 369.64792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)SC(C)N(C)C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)SC(C)N(C)C

InChI

InChI=1S/C22H43NOS/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(24)25-21(2)23(3)4/h12-13,21H,5-11,14-20H2,1-4H3/b13-12+