(2S)-2-[2-[2-(phenylmethoxycarbonylamino)ethanoylamino]ethanoylamino]pentanoate

Systemtic Name: (2S)-2-[2-[2-(phenylmethoxycarbonylamino)ethanoylamino]ethanoylamino]pentanoate Openeye Name: (2S)-2-[[2-[[2-(benzyloxycarbonylamino)acetyl]amino]acetyl]amino]pentanoate CAS Name: (2S)-2-[[1-oxo-2-[[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]ethyl]amino]pentanoate IUPAC Name: (2S)-2-[[2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]acetyl]amino]pentanoate Traditional Name: (2S)-2-[[2-[[2-(benzyloxycarbonylamino)acetyl]amino]acetyl]amino]valerate Formula: C17H22N3O6- MolecularWeight: 364.37308

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)[O-])NC(=O)CNC(=O)CNC(=O)OCC1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O6/c1-2-6-13(16(23)24)20-15(22)10-18-14(21)9-19-17(25)26-11-12-7-4-3-5-8-12/h3-5,7-8,13H,2,6,9-11H2,1H3,(H,18,21)(H,19,25)(H,20,22)(H,23,24)/p-1/t13-/m0/s1