methyl-[(2S)-3-(3-methyl-4-propan-2-yl-phenoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: methyl-[(2S)-3-(3-methyl-4-propan-2-yl-phenoxy)-2-oxidanyl-propyl]azanium Openeye Name: [(2S)-2-hydroxy-3-(4-isopropyl-3-methyl-phenoxy)propyl]-methyl-ammonium CAS Name: [(2S)-2-hydroxy-3-(3-methyl-4-propan-2-ylphenoxy)propyl]-methylammonium IUPAC Name: [(2S)-2-hydroxy-3-(3-methyl-4-propan-2-ylphenoxy)propyl]-methylazanium Traditional Name: [(2S)-2-hydroxy-3-(4-isopropyl-3-methyl-phenoxy)propyl]-methyl-ammonium Formula: C14H24NO2+ MolecularWeight: 238.34586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(C[NH2+]C)O)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OC[C@H](C[NH2+]C)O)C(C)C

InChI

InChI=1S/C14H23NO2/c1-10(2)14-6-5-13(7-11(14)3)17-9-12(16)8-15-4/h5-7,10,12,15-16H,8-9H2,1-4H3/p+1/t12-/m0/s1