[(3S)-3-(4-ethylphenyl)-3-(3-propan-2-ylphenoxy)propyl]azanium

Systemtic Name: [(3S)-3-(4-ethylphenyl)-3-(3-propan-2-ylphenoxy)propyl]azanium Openeye Name: [(3S)-3-(4-ethylphenyl)-3-(3-isopropylphenoxy)propyl]ammonium CAS Name: [(3S)-3-(4-ethylphenyl)-3-(3-propan-2-ylphenoxy)propyl]ammonium IUPAC Name: [(3S)-3-(4-ethylphenyl)-3-(3-propan-2-ylphenoxy)propyl]azanium Traditional Name: [(3S)-3-(4-ethylphenyl)-3-(3-isopropylphenoxy)propyl]ammonium Formula: C20H28NO+ MolecularWeight: 298.44242

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CC[NH3+])OC2=CC=CC(=C2)C(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](CC[NH3+])OC2=CC=CC(=C2)C(C)C

InChI

InChI=1S/C20H27NO/c1-4-16-8-10-17(11-9-16)20(12-13-21)22-19-7-5-6-18(14-19)15(2)3/h5-11,14-15,20H,4,12-13,21H2,1-3H3/p+1/t20-/m0/s1