(2S,3S)-3-oxidanyl-2-(2-phenoxyethanoylamino)hept-6-enoic acid

Systemtic Name: (2S,3S)-3-oxidanyl-2-(2-phenoxyethanoylamino)hept-6-enoic acid Openeye Name: (2S,3S)-3-hydroxy-2-[(2-phenoxyacetyl)amino]hept-6-enoic acid CAS Name: (2S,3S)-3-hydroxy-2-[(1-oxo-2-phenoxyethyl)amino]-6-heptenoic acid IUPAC Name: (2S,3S)-3-hydroxy-2-[(2-phenoxyacetyl)amino]hept-6-enoic acid Traditional Name: (2S,3S)-3-hydroxy-2-[(2-phenoxyacetyl)amino]hept-6-enoic acid Formula: C15H19NO5 MolecularWeight: 293.31506

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC(C(C(=O)O)NC(=O)COC1=CC=CC=C1)O

Isomeric SMILES

C=CCC[C@@H]([C@@H](C(=O)O)NC(=O)COC1=CC=CC=C1)O

InChI

InChI=1S/C15H19NO5/c1-2-3-9-12(17)14(15(19)20)16-13(18)10-21-11-7-5-4-6-8-11/h2,4-8,12,14,17H,1,3,9-10H2,(H,16,18)(H,19,20)/t12-,14-/m0/s1