2-(dodecanoylamino)-4-methylsulfanyl-butanoate

Systemtic Name: 2-(dodecanoylamino)-4-methylsulfanyl-butanoate Openeye Name: 2-(dodecanoylamino)-4-methylsulfanyl-butanoate CAS Name: 4-(methylthio)-2-(1-oxododecylamino)butanoate IUPAC Name: 2-(dodecanoylamino)-4-methylsulfanylbutanoate Traditional Name: 2-(lauroylamino)-4-(methylthio)butyrate Formula: C17H32NO3S- MolecularWeight: 330.50588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC(=O)NC(CCSC)C(=O)[O-]

InChI

InChI=1S/C17H33NO3S/c1-3-4-5-6-7-8-9-10-11-12-16(19)18-15(17(20)21)13-14-22-2/h15H,3-14H2,1-2H3,(H,18,19)(H,20,21)/p-1