[(2S)-2-(4-tert-butylphenyl)-2-(3-propan-2-ylphenoxy)ethyl]azanium

Systemtic Name: [(2S)-2-(4-tert-butylphenyl)-2-(3-propan-2-ylphenoxy)ethyl]azanium Openeye Name: [(2S)-2-(4-tert-butylphenyl)-2-(3-isopropylphenoxy)ethyl]ammonium CAS Name: [(2S)-2-(4-tert-butylphenyl)-2-(3-propan-2-ylphenoxy)ethyl]ammonium IUPAC Name: [(2S)-2-(4-tert-butylphenyl)-2-(3-propan-2-ylphenoxy)ethyl]azanium Traditional Name: [(2S)-2-(4-tert-butylphenyl)-2-(3-isopropylphenoxy)ethyl]ammonium Formula: C21H30NO+ MolecularWeight: 312.469

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29NO/c1-15(2)17-7-6-8-19(13-17)23-20(14-22)16-9-11-18(12-10-16)21(3,4)5/h6-13,15,20H,14,22H2,1-5H3/p+1/t20-/m1/s1