methyl (2S)-3-oxidanyl-2-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]propanoate

Systemtic Name: methyl (2S)-3-oxidanyl-2-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]propanoate Openeye Name: methyl (2S)-3-hydroxy-2-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]propanoate CAS Name: (2S)-3-hydroxy-2-[[1-oxo-4-(2-oxo-1,3-benzoxazol-3-yl)butyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-hydroxy-2-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]propanoate Traditional Name: (2S)-3-hydroxy-2-[4-(2-keto-1,3-benzoxazol-3-yl)butanoylamino]propionic acid methyl ester Formula: C15H18N2O6 MolecularWeight: 322.31322

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)CCCN1C2=CC=CC=C2OC1=O

Isomeric SMILES

COC(=O)[C@H](CO)NC(=O)CCCN1C2=CC=CC=C2OC1=O

InChI

InChI=1S/C15H18N2O6/c1-22-14(20)10(9-18)16-13(19)7-4-8-17-11-5-2-3-6-12(11)23-15(17)21/h2-3,5-6,10,18H,4,7-9H2,1H3,(H,16,19)/t10-/m0/s1