3-[[3,3-dimethyl-2-oxidanyl-4-(phenylmethoxycarbonylamino)butanoyl]amino]propanoic acid

Systemtic Name: 3-[[3,3-dimethyl-2-oxidanyl-4-(phenylmethoxycarbonylamino)butanoyl]amino]propanoic acid Openeye Name: 3-[[4-(benzyloxycarbonylamino)-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanoic acid CAS Name: 3-[[2-hydroxy-3,3-dimethyl-1-oxo-4-(phenylmethoxycarbonylamino)butyl]amino]propanoic acid IUPAC Name: 3-[[2-hydroxy-3,3-dimethyl-4-(phenylmethoxycarbonylamino)butanoyl]amino]propanoic acid Traditional Name: 3-[[4-(benzyloxycarbonylamino)-2-hydroxy-3,3-dimethyl-butanoyl]amino]propionic acid Formula: C17H24N2O6 MolecularWeight: 352.38226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)OCC1=CC=CC=C1)C(C(=O)NCCC(=O)O)O

Isomeric SMILES

CC(C)(CNC(=O)OCC1=CC=CC=C1)C(C(=O)NCCC(=O)O)O

InChI

InChI=1S/C17H24N2O6/c1-17(2,14(22)15(23)18-9-8-13(20)21)11-19-16(24)25-10-12-6-4-3-5-7-12/h3-7,14,22H,8-11H2,1-2H3,(H,18,23)(H,19,24)(H,20,21)