[(2S)-2-[3,5-bis(dimethylaminooxycarbonyl)phenyl]-2-oxidanyl-ethyl]-tert-butyl-azanium

Systemtic Name: [(2S)-2-[3,5-bis(dimethylaminooxycarbonyl)phenyl]-2-oxidanyl-ethyl]-tert-butyl-azanium Openeye Name: [(2S)-2-[3,5-bis(dimethylaminooxycarbonyl)phenyl]-2-hydroxy-ethyl]-tert-butyl-ammonium CAS Name: [(2S)-2-[3,5-bis[dimethylaminooxy(oxo)methyl]phenyl]-2-hydroxyethyl]-tert-butylammonium IUPAC Name: [(2S)-2-[3,5-bis(dimethylaminooxycarbonyl)phenyl]-2-hydroxyethyl]-tert-butylazanium Traditional Name: [(2S)-2-[3,5-bis(dimethylaminooxycarbonyl)phenyl]-2-hydroxy-ethyl]-tert-butyl-ammonium Formula: C18H30N3O5+ MolecularWeight: 368.4479

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CC(C1=CC(=CC(=C1)C(=O)ON(C)C)C(=O)ON(C)C)O

Isomeric SMILES

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

InChI

InChI=1S/C18H29N3O5/c1-18(2,3)19-11-15(22)12-8-13(16(23)25-20(4)5)10-14(9-12)17(24)26-21(6)7/h8-10,15,19,22H,11H2,1-7H3/p+1/t15-/m1/s1