[(2S)-2-oxidanyl-3-(2-propan-2-ylphenoxy)propyl]-propyl-azanium

Systemtic Name: [(2S)-2-oxidanyl-3-(2-propan-2-ylphenoxy)propyl]-propyl-azanium Openeye Name: [(2S)-2-hydroxy-3-(2-isopropylphenoxy)propyl]-propyl-ammonium CAS Name: [(2S)-2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-propylammonium IUPAC Name: [(2S)-2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-propylazanium Traditional Name: [(2S)-2-hydroxy-3-(2-isopropylphenoxy)propyl]-propyl-ammonium Formula: C15H26NO2+ MolecularWeight: 252.37244

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CC(COC1=CC=CC=C1C(C)C)O

Isomeric SMILES

CCC[NH2+]C[C@@H](COC1=CC=CC=C1C(C)C)O

InChI

InChI=1S/C15H25NO2/c1-4-9-16-10-13(17)11-18-15-8-6-5-7-14(15)12(2)3/h5-8,12-13,16-17H,4,9-11H2,1-3H3/p+1/t13-/m0/s1