2-dimethylaminoethyl-[(2S)-2-[2-(2-methylpropoxy)phenyl]-2-oxidanyl-ethyl]azanium

Systemtic Name: 2-dimethylaminoethyl-[(2S)-2-[2-(2-methylpropoxy)phenyl]-2-oxidanyl-ethyl]azanium Openeye Name: 2-dimethylaminoethyl-[(2S)-2-hydroxy-2-(2-isobutoxyphenyl)ethyl]ammonium CAS Name: 2-dimethylaminoethyl-[(2S)-2-hydroxy-2-[2-(2-methylpropoxy)phenyl]ethyl]ammonium IUPAC Name: 2-dimethylaminoethyl-[(2S)-2-hydroxy-2-[2-(2-methylpropoxy)phenyl]ethyl]azanium Traditional Name: 2-dimethylaminoethyl-[(2S)-2-hydroxy-2-(2-isobutoxyphenyl)ethyl]ammonium Formula: C16H29N2O2+ MolecularWeight: 281.41366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC=C1C(C[NH2+]CCN(C)C)O

Isomeric SMILES

CC(C)COC1=CC=CC=C1[C@@H](C[NH2+]CCN(C)C)O

InChI

InChI=1S/C16H28N2O2/c1-13(2)12-20-16-8-6-5-7-14(16)15(19)11-17-9-10-18(3)4/h5-8,13,15,17,19H,9-12H2,1-4H3/p+1/t15-/m1/s1