2-[4-(2-azidoethanoyl)-2-(2-ethoxy-2-oxidanylidene-ethoxy)phenoxy]-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[4-(2-azidoethanoyl)-2-(2-ethoxy-2-oxidanylidene-ethoxy)phenoxy]-3,3-dimethyl-butanoic acid Openeye Name: 2-[4-(2-azidoacetyl)-2-(2-ethoxy-2-oxo-ethoxy)phenoxy]-3,3-dimethyl-butanoic acid CAS Name: 2-[4-(2-azido-1-oxoethyl)-2-(2-ethoxy-2-oxoethoxy)phenoxy]-3,3-dimethylbutanoic acid IUPAC Name: 2-[4-(2-azidoacetyl)-2-(2-ethoxy-2-oxoethoxy)phenoxy]-3,3-dimethylbutanoic acid Traditional Name: 2-[4-(2-azidoacetyl)-2-(2-ethoxy-2-keto-ethoxy)phenoxy]-3,3-dimethyl-butyric acid Formula: C18H23N3O7 MolecularWeight: 393.39112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=CC(=C1)C(=O)CN=[N+]=[N-])OC(C(=O)O)C(C)(C)C

Isomeric SMILES

CCOC(=O)COC1=C(C=CC(=C1)C(=O)CN=[N+]=[N-])OC(C(=O)O)C(C)(C)C

InChI

InChI=1S/C18H23N3O7/c1-5-26-15(23)10-27-14-8-11(12(22)9-20-21-19)6-7-13(14)28-16(17(24)25)18(2,3)4/h6-8,16H,5,9-10H2,1-4H3,(H,24,25)