[(2S)-2-(3-butoxyphenyl)-2-oxidanyl-ethyl]-propan-2-yl-azanium

Systemtic Name: [(2S)-2-(3-butoxyphenyl)-2-oxidanyl-ethyl]-propan-2-yl-azanium Openeye Name: [(2S)-2-(3-butoxyphenyl)-2-hydroxy-ethyl]-isopropyl-ammonium CAS Name: [(2S)-2-(3-butoxyphenyl)-2-hydroxyethyl]-propan-2-ylammonium IUPAC Name: [(2S)-2-(3-butoxyphenyl)-2-hydroxyethyl]-propan-2-ylazanium Traditional Name: [(2S)-2-(3-butoxyphenyl)-2-hydroxy-ethyl]-isopropyl-ammonium Formula: C15H26NO2+ MolecularWeight: 252.37244

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25NO2/c1-4-5-9-18-14-8-6-7-13(10-14)15(17)11-16-12(2)3/h6-8,10,12,15-17H,4-5,9,11H2,1-3H3/p+1/t15-/m1/s1