[(1R,2R)-2-azido-3-methoxy-3-oxidanylidene-1-phenyl-propyl] butanoate

Systemtic Name: [(1R,2R)-2-azido-3-methoxy-3-oxidanylidene-1-phenyl-propyl] butanoate Openeye Name: [(1R,2R)-2-azido-3-methoxy-3-oxo-1-phenyl-propyl] butanoate CAS Name: butanoic acid [(1R,2R)-2-azido-3-methoxy-3-oxo-1-phenylpropyl] ester IUPAC Name: [(1R,2R)-2-azido-3-methoxy-3-oxo-1-phenylpropyl] butanoate Traditional Name: butyric acid [(1R,2R)-2-azido-3-keto-3-methoxy-1-phenyl-propyl] ester Formula: C14H17N3O4 MolecularWeight: 291.30248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(C1=CC=CC=C1)C(C(=O)OC)N=[N+]=[N-]

Isomeric SMILES

CCCC(=O)O[C@H](C1=CC=CC=C1)[C@H](C(=O)OC)N=[N+]=[N-]

InChI

InChI=1S/C14H17N3O4/c1-3-7-11(18)21-13(10-8-5-4-6-9-10)12(16-17-15)14(19)20-2/h4-6,8-9,12-13H,3,7H2,1-2H3/t12-,13-/m1/s1