[(2S)-2-(4-tert-butylphenyl)-2-(2,3-dimethylphenoxy)ethyl]azanium

Systemtic Name: [(2S)-2-(4-tert-butylphenyl)-2-(2,3-dimethylphenoxy)ethyl]azanium Openeye Name: [(2S)-2-(4-tert-butylphenyl)-2-(2,3-dimethylphenoxy)ethyl]ammonium CAS Name: [(2S)-2-(4-tert-butylphenyl)-2-(2,3-dimethylphenoxy)ethyl]ammonium IUPAC Name: [(2S)-2-(4-tert-butylphenyl)-2-(2,3-dimethylphenoxy)ethyl]azanium Traditional Name: [(2S)-2-(4-tert-butylphenyl)-2-(2,3-dimethylphenoxy)ethyl]ammonium Formula: C20H28NO+ MolecularWeight: 298.44242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OC(C[NH3+])C2=CC=C(C=C2)C(C)(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)O[C@H](C[NH3+])C2=CC=C(C=C2)C(C)(C)C)C

InChI

InChI=1S/C20H27NO/c1-14-7-6-8-18(15(14)2)22-19(13-21)16-9-11-17(12-10-16)20(3,4)5/h6-12,19H,13,21H2,1-5H3/p+1/t19-/m1/s1