methyl 11-[[(2S)-2-(dodecanoylamino)-3-methyl-butanoyl]amino]undecanoate

Systemtic Name: methyl 11-[[(2S)-2-(dodecanoylamino)-3-methyl-butanoyl]amino]undecanoate Openeye Name: methyl 11-[[(2S)-2-(dodecanoylamino)-3-methyl-butanoyl]amino]undecanoate CAS Name: 11-[[(2S)-3-methyl-1-oxo-2-(1-oxododecylamino)butyl]amino]undecanoic acid methyl ester IUPAC Name: methyl 11-[[(2S)-2-(dodecanoylamino)-3-methylbutanoyl]amino]undecanoate Traditional Name: 11-[[(2S)-2-(lauroylamino)-3-methyl-butanoyl]amino]undecanoic acid methyl ester Formula: C29H56N2O4 MolecularWeight: 496.76594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(C(C)C)C(=O)NCCCCCCCCCCC(=O)OC

Isomeric SMILES

CCCCCCCCCCCC(=O)N[C@@H](C(C)C)C(=O)NCCCCCCCCCCC(=O)OC

InChI

InChI=1S/C29H56N2O4/c1-5-6-7-8-9-10-13-16-19-22-26(32)31-28(25(2)3)29(34)30-24-21-18-15-12-11-14-17-20-23-27(33)35-4/h25,28H,5-24H2,1-4H3,(H,30,34)(H,31,32)/t28-/m0/s1