2-tert-butyl-2-[di(hexadecanoyl)amino]-4,4-dimethyl-3-sulfanyl-pentanoic acid

Systemtic Name: 2-tert-butyl-2-[di(hexadecanoyl)amino]-4,4-dimethyl-3-sulfanyl-pentanoic acid Openeye Name: 2-tert-butyl-2-[di(hexadecanoyl)amino]-4,4-dimethyl-3-sulfanyl-pentanoic acid CAS Name: 2-[bis(1-oxohexadecyl)amino]-2-tert-butyl-3-mercapto-4,4-dimethylpentanoic acid IUPAC Name: 2-tert-butyl-2-[di(hexadecanoyl)amino]-4,4-dimethyl-3-sulfanylpentanoic acid Traditional Name: 2-tert-butyl-2-[di(hexadecanoyl)amino]-3-mercapto-4,4-dimethyl-valeric acid Formula: C43H83NO4S MolecularWeight: 710.18842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)N(C(=O)CCCCCCCCCCCCCCC)C(C(C(C)(C)C)S)(C(=O)O)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N(C(=O)CCCCCCCCCCCCCCC)C(C(C(C)(C)C)S)(C(=O)O)C(C)(C)C

InChI

InChI=1S/C43H83NO4S/c1-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37(45)44(43(40(47)48,42(6,7)8)39(49)41(3,4)5)38(46)36-34-32-30-28-26-24-22-20-18-16-14-12-10-2/h39,49H,9-36H2,1-8H3,(H,47,48)