[(2S)-2-(2-butoxyphenyl)-2-oxidanyl-ethyl]-propyl-azanium

Systemtic Name: [(2S)-2-(2-butoxyphenyl)-2-oxidanyl-ethyl]-propyl-azanium Openeye Name: [(2S)-2-(2-butoxyphenyl)-2-hydroxy-ethyl]-propyl-ammonium CAS Name: [(2S)-2-(2-butoxyphenyl)-2-hydroxyethyl]-propylammonium IUPAC Name: [(2S)-2-(2-butoxyphenyl)-2-hydroxyethyl]-propylazanium Traditional Name: [(2S)-2-(2-butoxyphenyl)-2-hydroxy-ethyl]-propyl-ammonium Formula: C15H26NO2+ MolecularWeight: 252.37244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C(C[NH2+]CCC)O

Isomeric SMILES

CCCCOC1=CC=CC=C1[C@@H](C[NH2+]CCC)O

InChI

InChI=1S/C15H25NO2/c1-3-5-11-18-15-9-7-6-8-13(15)14(17)12-16-10-4-2/h6-9,14,16-17H,3-5,10-12H2,1-2H3/p+1/t14-/m1/s1