(2R)-2-[[(2S)-5-azanyl-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoyl]amino]propanoic acid

Systemtic Name: (2R)-2-[[(2S)-5-azanyl-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoyl]amino]propanoic acid Openeye Name: (2R)-2-[[(2S)-5-amino-2-(benzyloxycarbonylamino)-5-oxo-pentanoyl]amino]propanoic acid CAS Name: (2R)-2-[[(2S)-5-amino-1,5-dioxo-2-(phenylmethoxycarbonylamino)pentyl]amino]propanoic acid IUPAC Name: (2R)-2-[[(2S)-5-amino-5-oxo-2-(phenylmethoxycarbonylamino)pentanoyl]amino]propanoic acid Traditional Name: (2R)-2-[[(2S)-5-amino-2-(benzyloxycarbonylamino)-5-keto-pentanoyl]amino]propionic acid Formula: C16H21N3O6 MolecularWeight: 351.35444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O6/c1-10(15(22)23)18-14(21)12(7-8-13(17)20)19-16(24)25-9-11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3,(H2,17,20)(H,18,21)(H,19,24)(H,22,23)/t10-,12+/m1/s1