2-(dodecanoylamino)-3-phenyl-propanoate

Systemtic Name: 2-(dodecanoylamino)-3-phenyl-propanoate Openeye Name: 2-(dodecanoylamino)-3-phenyl-propanoate CAS Name: 2-(1-oxododecylamino)-3-phenylpropanoate IUPAC Name: 2-(dodecanoylamino)-3-phenylpropanoate Traditional Name: 2-(lauroylamino)-3-phenyl-propionate Formula: C21H32NO3- MolecularWeight: 346.48368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(CC1=CC=CC=C1)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC(=O)NC(CC1=CC=CC=C1)C(=O)[O-]

InChI

InChI=1S/C21H33NO3/c1-2-3-4-5-6-7-8-9-13-16-20(23)22-19(21(24)25)17-18-14-11-10-12-15-18/h10-12,14-15,19H,2-9,13,16-17H2,1H3,(H,22,23)(H,24,25)/p-1