[(2S)-2-(azidomethyl)-3-(4-tert-butylphenyl)propyl] 2,2-dimethylpropanoate

Systemtic Name: [(2S)-2-(azidomethyl)-3-(4-tert-butylphenyl)propyl] 2,2-dimethylpropanoate Openeye Name: [(2S)-2-(azidomethyl)-3-(4-tert-butylphenyl)propyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(2S)-2-(azidomethyl)-3-(4-tert-butylphenyl)propyl] ester IUPAC Name: [(2S)-2-(azidomethyl)-3-(4-tert-butylphenyl)propyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(2S)-2-(azidomethyl)-3-(4-tert-butylphenyl)propyl] ester Formula: C19H29N3O2 MolecularWeight: 331.45246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3O2/c1-18(2,3)16-9-7-14(8-10-16)11-15(12-21-22-20)13-24-17(23)19(4,5)6/h7-10,15H,11-13H2,1-6H3/t15-/m0/s1