3-(2-methylpropoxy)propyl-[(1R)-1-(4-methylsulfonylphenyl)ethyl]azanium

Systemtic Name: 3-(2-methylpropoxy)propyl-[(1R)-1-(4-methylsulfonylphenyl)ethyl]azanium Openeye Name: 3-isobutoxypropyl-[(1R)-1-(4-methylsulfonylphenyl)ethyl]ammonium CAS Name: 3-(2-methylpropoxy)propyl-[(1R)-1-(4-methylsulfonylphenyl)ethyl]ammonium IUPAC Name: 3-(2-methylpropoxy)propyl-[(1R)-1-(4-methylsulfonylphenyl)ethyl]azanium Traditional Name: 3-isobutoxypropyl-[(1R)-1-(4-mesylphenyl)ethyl]ammonium Formula: C16H28NO3S+ MolecularWeight: 314.46342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCCC[NH2+]C(C)C1=CC=C(C=C1)S(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C16H27NO3S/c1-13(2)12-20-11-5-10-17-14(3)15-6-8-16(9-7-15)21(4,18)19/h6-9,13-14,17H,5,10-12H2,1-4H3/p+1/t14-/m1/s1