(2S)-2-(phenylmethoxycarbonylamino)-3-(propanoylamino)propanoic acid

Systemtic Name: (2S)-2-(phenylmethoxycarbonylamino)-3-(propanoylamino)propanoic acid Openeye Name: (2S)-2-(benzyloxycarbonylamino)-3-(propanoylamino)propanoic acid CAS Name: (2S)-3-(1-oxopropylamino)-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: (2S)-2-(phenylmethoxycarbonylamino)-3-(propanoylamino)propanoic acid Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-propionamido-propionic acid Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NCC(C(=O)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCC(=O)NC[C@@H](C(=O)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C14H18N2O5/c1-2-12(17)15-8-11(13(18)19)16-14(20)21-9-10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3,(H,15,17)(H,16,20)(H,18,19)/t11-/m0/s1