(2S,3R)-3-azido-4-ethoxy-4-oxidanylidene-2-phenethyl-butanoic acid

Systemtic Name: (2S,3R)-3-azido-4-ethoxy-4-oxidanylidene-2-phenethyl-butanoic acid Openeye Name: (2S,3R)-3-azido-4-ethoxy-4-oxo-2-phenethyl-butanoic acid CAS Name: (2S,3R)-3-azido-4-ethoxy-4-oxo-2-phenethylbutanoic acid IUPAC Name: (2S,3R)-3-azido-4-ethoxy-4-oxo-2-phenethylbutanoic acid Traditional Name: (2S,3R)-3-azido-4-ethoxy-4-keto-2-phenethyl-butyric acid Formula: C14H17N3O4 MolecularWeight: 291.30248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(CCC1=CC=CC=C1)C(=O)O)N=[N+]=[N-]

Isomeric SMILES

CCOC(=O)[C@@H]([C@H](CCC1=CC=CC=C1)C(=O)O)N=[N+]=[N-]

InChI

InChI=1S/C14H17N3O4/c1-2-21-14(20)12(16-17-15)11(13(18)19)9-8-10-6-4-3-5-7-10/h3-7,11-12H,2,8-9H2,1H3,(H,18,19)/t11-,12+/m0/s1