2-(2,2,6,6-tetramethyl-1-octadecyl-piperidin-4-ylidene)ethanethioic S-acid

Systemtic Name: 2-(2,2,6,6-tetramethyl-1-octadecyl-piperidin-4-ylidene)ethanethioic S-acid Openeye Name: 2-(2,2,6,6-tetramethyl-1-octadecyl-4-piperidylidene)ethanethioic S-acid CAS Name: 2-(2,2,6,6-tetramethyl-1-octadecyl-4-piperidinylidene)ethanethioic S-acid IUPAC Name: 2-(2,2,6,6-tetramethyl-1-octadecylpiperidin-4-ylidene)ethanethioic S-acid Traditional Name: 2-(2,2,6,6-tetramethyl-1-stearyl-4-piperidylidene)thioacetic acid Formula: C29H55NOS MolecularWeight: 465.8181

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN1C(CC(=CC(=O)S)CC1(C)C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN1C(CC(=CC(=O)S)CC1(C)C)(C)C

InChI

InChI=1S/C29H55NOS/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-30-28(2,3)24-26(23-27(31)32)25-29(30,4)5/h23H,6-22,24-25H2,1-5H3,(H,31,32)