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

Systemtic Name: [(2S)-2-(2-butoxyphenyl)-2-oxidanyl-propyl]-propan-2-yl-azanium Openeye Name: [(2S)-2-(2-butoxyphenyl)-2-hydroxy-propyl]-isopropyl-ammonium CAS Name: [(2S)-2-(2-butoxyphenyl)-2-hydroxypropyl]-propan-2-ylammonium IUPAC Name: [(2S)-2-(2-butoxyphenyl)-2-hydroxypropyl]-propan-2-ylazanium Traditional Name: [(2S)-2-(2-butoxyphenyl)-2-hydroxy-propyl]-isopropyl-ammonium Formula: C16H28NO2+ MolecularWeight: 266.39902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27NO2/c1-5-6-11-19-15-10-8-7-9-14(15)16(4,18)12-17-13(2)3/h7-10,13,17-18H,5-6,11-12H2,1-4H3/p+1/t16-/m1/s1