methyl N-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]carbamate

Systemtic Name: methyl N-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]carbamate Openeye Name: methyl N-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]carbamate CAS Name: N-[[(2S)-2-acetamido-1-oxo-3-phenylpropyl]amino]carbamic acid methyl ester IUPAC Name: methyl N-[[(2S)-2-acetamido-3-phenylpropanoyl]amino]carbamate Traditional Name: N-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]carbamic acid methyl ester Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=CC=C1)C(=O)NNC(=O)OC

Isomeric SMILES

CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NNC(=O)OC

InChI

InChI=1S/C13H17N3O4/c1-9(17)14-11(8-10-6-4-3-5-7-10)12(18)15-16-13(19)20-2/h3-7,11H,8H2,1-2H3,(H,14,17)(H,15,18)(H,16,19)/t11-/m0/s1