(2S)-3-[[(2S)-1-methoxy-1-oxidanylidene-propan-2-yl]carbamoylamino]-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: (2S)-3-[[(2S)-1-methoxy-1-oxidanylidene-propan-2-yl]carbamoylamino]-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: (2S)-2-(benzyloxycarbonylamino)-3-[[(1S)-2-methoxy-1-methyl-2-oxo-ethyl]carbamoylamino]propanoic acid CAS Name: (2S)-3-[[[[(2S)-1-methoxy-1-oxopropan-2-yl]amino]-oxomethyl]amino]-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: (2S)-3-[[(2S)-1-methoxy-1-oxopropan-2-yl]carbamoylamino]-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-[[(1S)-2-keto-2-methoxy-1-methyl-ethyl]carbamoylamino]propionic acid Formula: C16H21N3O7 MolecularWeight: 367.35384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O7/c1-10(14(22)25-2)18-15(23)17-8-12(13(20)21)19-16(24)26-9-11-6-4-3-5-7-11/h3-7,10,12H,8-9H2,1-2H3,(H,19,24)(H,20,21)(H2,17,18,23)/t10-,12-/m0/s1