tert-butyl-[(2S)-2-[4-(2-methylpropoxy)phenyl]-2-oxidanyl-propyl]azanium

Systemtic Name: tert-butyl-[(2S)-2-[4-(2-methylpropoxy)phenyl]-2-oxidanyl-propyl]azanium Openeye Name: tert-butyl-[(2S)-2-hydroxy-2-(4-isobutoxyphenyl)propyl]ammonium CAS Name: tert-butyl-[(2S)-2-hydroxy-2-[4-(2-methylpropoxy)phenyl]propyl]ammonium IUPAC Name: tert-butyl-[(2S)-2-hydroxy-2-[4-(2-methylpropoxy)phenyl]propyl]azanium Traditional Name: tert-butyl-[(2S)-2-hydroxy-2-(4-isobutoxyphenyl)propyl]ammonium Formula: C17H30NO2+ MolecularWeight: 280.4256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(C)(C[NH2+]C(C)(C)C)O

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)[C@@](C)(C[NH2+]C(C)(C)C)O

InChI

InChI=1S/C17H29NO2/c1-13(2)11-20-15-9-7-14(8-10-15)17(6,19)12-18-16(3,4)5/h7-10,13,18-19H,11-12H2,1-6H3/p+1/t17-/m1/s1