(phenylmethyl) (2S)-2-[(4-methylphenyl)carbonylamino]-3-oxidanyl-propanoate

Systemtic Name: (phenylmethyl) (2S)-2-[(4-methylphenyl)carbonylamino]-3-oxidanyl-propanoate Openeye Name: benzyl (2S)-3-hydroxy-2-[(4-methylbenzoyl)amino]propanoate CAS Name: (2S)-3-hydroxy-2-[[(4-methylphenyl)-oxomethyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-3-hydroxy-2-[(4-methylbenzoyl)amino]propanoate Traditional Name: (2S)-3-hydroxy-2-(p-toluoylamino)propionic acid benzyl ester Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(CO)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@@H](CO)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H19NO4/c1-13-7-9-15(10-8-13)17(21)19-16(11-20)18(22)23-12-14-5-3-2-4-6-14/h2-10,16,20H,11-12H2,1H3,(H,19,21)/t16-/m0/s1