[(3R)-3-(4-tert-butylphenyl)-3-(2-ethylphenoxy)propyl]azanium

Systemtic Name: [(3R)-3-(4-tert-butylphenyl)-3-(2-ethylphenoxy)propyl]azanium Openeye Name: [(3R)-3-(4-tert-butylphenyl)-3-(2-ethylphenoxy)propyl]ammonium CAS Name: [(3R)-3-(4-tert-butylphenyl)-3-(2-ethylphenoxy)propyl]ammonium IUPAC Name: [(3R)-3-(4-tert-butylphenyl)-3-(2-ethylphenoxy)propyl]azanium Traditional Name: [(3R)-3-(4-tert-butylphenyl)-3-(2-ethylphenoxy)propyl]ammonium Formula: C21H30NO+ MolecularWeight: 312.469

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1OC(CC[NH3+])C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCC1=CC=CC=C1O[C@H](CC[NH3+])C2=CC=C(C=C2)C(C)(C)C

InChI

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