2-[4-(2-azidoethanoyl)-2-(carboxymethyloxy)phenoxy]-2-tert-butyl-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[4-(2-azidoethanoyl)-2-(carboxymethyloxy)phenoxy]-2-tert-butyl-3,3-dimethyl-butanoic acid Openeye Name: 2-[4-(2-azidoacetyl)-2-(carboxymethyloxy)phenoxy]-2-tert-butyl-3,3-dimethyl-butanoic acid CAS Name: 2-[4-(2-azido-1-oxoethyl)-2-(carboxymethyloxy)phenoxy]-2-tert-butyl-3,3-dimethylbutanoic acid IUPAC Name: 2-[4-(2-azidoacetyl)-2-(carboxymethyloxy)phenoxy]-2-tert-butyl-3,3-dimethylbutanoic acid Traditional Name: 2-[4-(2-azidoacetyl)-2-(carboxymethyloxy)phenoxy]-2-tert-butyl-3,3-dimethyl-butyric acid Formula: C20H27N3O7 MolecularWeight: 421.44428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)O)(C(C)(C)C)OC1=C(C=C(C=C1)C(=O)CN=[N+]=[N-])OCC(=O)O

Isomeric SMILES

CC(C)(C)C(C(=O)O)(C(C)(C)C)OC1=C(C=C(C=C1)C(=O)CN=[N+]=[N-])OCC(=O)O

InChI

InChI=1S/C20H27N3O7/c1-18(2,3)20(17(27)28,19(4,5)6)30-14-8-7-12(13(24)10-22-23-21)9-15(14)29-11-16(25)26/h7-9H,10-11H2,1-6H3,(H,25,26)(H,27,28)