2-methylpropyl-[(2S)-2-oxidanyl-2-(4-propoxyphenyl)propyl]azanium

Systemtic Name: 2-methylpropyl-[(2S)-2-oxidanyl-2-(4-propoxyphenyl)propyl]azanium Openeye Name: [(2S)-2-hydroxy-2-(4-propoxyphenyl)propyl]-isobutyl-ammonium CAS Name: [(2S)-2-hydroxy-2-(4-propoxyphenyl)propyl]-(2-methylpropyl)ammonium IUPAC Name: [(2S)-2-hydroxy-2-(4-propoxyphenyl)propyl]-(2-methylpropyl)azanium Traditional Name: [(2S)-2-hydroxy-2-(4-propoxyphenyl)propyl]-isobutyl-ammonium Formula: C16H28NO2+ MolecularWeight: 266.39902

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(C)(C[NH2+]CC(C)C)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)[C@@](C)(C[NH2+]CC(C)C)O

InChI

InChI=1S/C16H27NO2/c1-5-10-19-15-8-6-14(7-9-15)16(4,18)12-17-11-13(2)3/h6-9,13,17-18H,5,10-12H2,1-4H3/p+1/t16-/m1/s1