2-(octadecylsulfanylmethyl)butanedioic acid

Systemtic Name: 2-(octadecylsulfanylmethyl)butanedioic acid Openeye Name: 2-(octadecylsulfanylmethyl)butanedioic acid CAS Name: 2-[(octadecylthio)methyl]butanedioic acid IUPAC Name: 2-(octadecylsulfanylmethyl)butanedioic acid Traditional Name: 2-[(stearylthio)methyl]succinic acid Formula: C23H44O4S MolecularWeight: 416.65806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSCC(CC(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSCC(CC(=O)O)C(=O)O

InChI

InChI=1S/C23H44O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-28-20-21(23(26)27)19-22(24)25/h21H,2-20H2,1H3,(H,24,25)(H,26,27)