[(4S)-4-(4-methoxyphenyl)-4-(2-propan-2-ylphenoxy)butyl]azanium

Systemtic Name: [(4S)-4-(4-methoxyphenyl)-4-(2-propan-2-ylphenoxy)butyl]azanium Openeye Name: [(4S)-4-(2-isopropylphenoxy)-4-(4-methoxyphenyl)butyl]ammonium CAS Name: [(4S)-4-(4-methoxyphenyl)-4-(2-propan-2-ylphenoxy)butyl]ammonium IUPAC Name: [(4S)-4-(4-methoxyphenyl)-4-(2-propan-2-ylphenoxy)butyl]azanium Traditional Name: [(4S)-4-(2-isopropylphenoxy)-4-(4-methoxyphenyl)butyl]ammonium Formula: C20H28NO2+ MolecularWeight: 314.44182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OC(CCC[NH3+])C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)C1=CC=CC=C1O[C@@H](CCC[NH3+])C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H27NO2/c1-15(2)18-7-4-5-8-20(18)23-19(9-6-14-21)16-10-12-17(22-3)13-11-16/h4-5,7-8,10-13,15,19H,6,9,14,21H2,1-3H3/p+1/t19-/m0/s1