sodium (2S)-2-(dodecanoylamino)-4-methyl-pentanoate

Systemtic Name: sodium (2S)-2-(dodecanoylamino)-4-methyl-pentanoate Openeye Name: sodium (2S)-2-(dodecanoylamino)-4-methyl-pentanoate CAS Name: sodium (2S)-4-methyl-2-(1-oxododecylamino)pentanoate IUPAC Name: sodium (2S)-2-(dodecanoylamino)-4-methylpentanoate Traditional Name: sodium (2S)-2-(lauroylamino)-4-methyl-valerate Formula: C18H34NNaO3 MolecularWeight: 335.45723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(CC(C)C)C(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCC(=O)N[C@@H](CC(C)C)C(=O)[O-].[Na+]

InChI

InChI=1S/C18H35NO3.Na/c1-4-5-6-7-8-9-10-11-12-13-17(20)19-16(18(21)22)14-15(2)3;/h15-16H,4-14H2,1-3H3,(H,19,20)(H,21,22);/q;+1/p-1/t16-;/m0./s1