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

Systemtic Name: [(4S)-4-(4-methoxyphenyl)-4-(4-propan-2-ylphenoxy)butyl]azanium Openeye Name: [(4S)-4-(4-isopropylphenoxy)-4-(4-methoxyphenyl)butyl]ammonium CAS Name: [(4S)-4-(4-methoxyphenyl)-4-(4-propan-2-ylphenoxy)butyl]ammonium IUPAC Name: [(4S)-4-(4-methoxyphenyl)-4-(4-propan-2-ylphenoxy)butyl]azanium Traditional Name: [(4S)-4-(4-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=C(C=C1)OC(CCC[NH3+])C2=CC=C(C=C2)OC

Isomeric SMILES

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

InChI

InChI=1S/C20H27NO2/c1-15(2)16-6-12-19(13-7-16)23-20(5-4-14-21)17-8-10-18(22-3)11-9-17/h6-13,15,20H,4-5,14,21H2,1-3H3/p+1/t20-/m0/s1