tert-butyl-[(2S)-3-(2-tert-butylphenoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: tert-butyl-[(2S)-3-(2-tert-butylphenoxy)-2-oxidanyl-propyl]azanium Openeye Name: tert-butyl-[(2S)-3-(2-tert-butylphenoxy)-2-hydroxy-propyl]ammonium CAS Name: tert-butyl-[(2S)-3-(2-tert-butylphenoxy)-2-hydroxypropyl]ammonium IUPAC Name: tert-butyl-[(2S)-3-(2-tert-butylphenoxy)-2-hydroxypropyl]azanium Traditional Name: tert-butyl-[(2S)-3-(2-tert-butylphenoxy)-2-hydroxy-propyl]ammonium Formula: C17H30NO2+ MolecularWeight: 280.4256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1OCC(C[NH2+]C(C)(C)C)O

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1OC[C@H](C[NH2+]C(C)(C)C)O

InChI

InChI=1S/C17H29NO2/c1-16(2,3)14-9-7-8-10-15(14)20-12-13(19)11-18-17(4,5)6/h7-10,13,18-19H,11-12H2,1-6H3/p+1/t13-/m0/s1