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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H29NO2/c1-13(2)10-18-11-15(19)12-20-16-8-6-7-14(9-16)17(3,4)5/h6-9,13,15,18-19H,10-12H2,1-5H3/p+1/t15-/m0/s1