[(2S)-2-[3,4-bis(2,2-dimethylpropanoyloxy)phenyl]-2-oxidanyl-ethyl]-methyl-azanium

Systemtic Name: [(2S)-2-[3,4-bis(2,2-dimethylpropanoyloxy)phenyl]-2-oxidanyl-ethyl]-methyl-azanium Openeye Name: [(2S)-2-[3,4-bis(2,2-dimethylpropanoyloxy)phenyl]-2-hydroxy-ethyl]-methyl-ammonium CAS Name: [(2S)-2-[3,4-bis(2,2-dimethyl-1-oxopropoxy)phenyl]-2-hydroxyethyl]-methylammonium IUPAC Name: [(2S)-2-[3,4-bis(2,2-dimethylpropanoyloxy)phenyl]-2-hydroxyethyl]-methylazanium Traditional Name: [(2S)-2-(3,4-dipivaloyloxyphenyl)-2-hydroxy-ethyl]-methyl-ammonium Formula: C19H30NO5+ MolecularWeight: 352.4452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=C(C=C(C=C1)C(C[NH2+]C)O)OC(=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C(=O)OC1=C(C=C(C=C1)[C@@H](C[NH2+]C)O)OC(=O)C(C)(C)C

InChI

InChI=1S/C19H29NO5/c1-18(2,3)16(22)24-14-9-8-12(13(21)11-20-7)10-15(14)25-17(23)19(4,5)6/h8-10,13,20-21H,11H2,1-7H3/p+1/t13-/m1/s1