methyl 3-[4-(2-azido-1-oxidanyl-ethyl)phenyl]propanoate

Systemtic Name: methyl 3-[4-(2-azido-1-oxidanyl-ethyl)phenyl]propanoate Openeye Name: methyl 3-[4-(2-azido-1-hydroxy-ethyl)phenyl]propanoate CAS Name: 3-[4-(2-azido-1-hydroxyethyl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(2-azido-1-hydroxyethyl)phenyl]propanoate Traditional Name: 3-[4-(2-azido-1-hydroxy-ethyl)phenyl]propionic acid methyl ester Formula: C12H15N3O3 MolecularWeight: 249.2658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O3/c1-18-12(17)7-4-9-2-5-10(6-3-9)11(16)8-14-15-13/h2-3,5-6,11,16H,4,7-8H2,1H3