[(1S)-1-(4-methoxyphenyl)ethyl]-[3-(2-methylpropoxy)propyl]azanium

Systemtic Name: [(1S)-1-(4-methoxyphenyl)ethyl]-[3-(2-methylpropoxy)propyl]azanium Openeye Name: 3-isobutoxypropyl-[(1S)-1-(4-methoxyphenyl)ethyl]ammonium CAS Name: [(1S)-1-(4-methoxyphenyl)ethyl]-[3-(2-methylpropoxy)propyl]ammonium IUPAC Name: [(1S)-1-(4-methoxyphenyl)ethyl]-[3-(2-methylpropoxy)propyl]azanium Traditional Name: 3-isobutoxypropyl-[(1S)-1-(4-methoxyphenyl)ethyl]ammonium Formula: C16H28NO2+ MolecularWeight: 266.39902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCCC[NH2+]C(C)C1=CC=C(C=C1)OC

Isomeric SMILES

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

InChI

InChI=1S/C16H27NO2/c1-13(2)12-19-11-5-10-17-14(3)15-6-8-16(18-4)9-7-15/h6-9,13-14,17H,5,10-12H2,1-4H3/p+1/t14-/m0/s1