3-(3-methyl-5-propan-2-yl-phenoxy)propyl-[(2S)-2-oxidanylpropyl]azanium

Systemtic Name: 3-(3-methyl-5-propan-2-yl-phenoxy)propyl-[(2S)-2-oxidanylpropyl]azanium Openeye Name: [(2S)-2-hydroxypropyl]-[3-(3-isopropyl-5-methyl-phenoxy)propyl]ammonium CAS Name: [(2S)-2-hydroxypropyl]-[3-(3-methyl-5-propan-2-ylphenoxy)propyl]ammonium IUPAC Name: [(2S)-2-hydroxypropyl]-[3-(3-methyl-5-propan-2-ylphenoxy)propyl]azanium Traditional Name: [(2S)-2-hydroxypropyl]-[3-(3-isopropyl-5-methyl-phenoxy)propyl]ammonium Formula: C16H28NO2+ MolecularWeight: 266.39902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27NO2/c1-12(2)15-8-13(3)9-16(10-15)19-7-5-6-17-11-14(4)18/h8-10,12,14,17-18H,5-7,11H2,1-4H3/p+1/t14-/m0/s1