[(2R)-2-oxidanyl-3-(2-propan-2-ylphenoxy)propyl]-phenethyl-azanium

Systemtic Name: [(2R)-2-oxidanyl-3-(2-propan-2-ylphenoxy)propyl]-phenethyl-azanium Openeye Name: [(2R)-2-hydroxy-3-(2-isopropylphenoxy)propyl]-phenethyl-ammonium CAS Name: [(2R)-2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-phenethylammonium IUPAC Name: [(2R)-2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-phenethylazanium Traditional Name: [(2R)-2-hydroxy-3-(2-isopropylphenoxy)propyl]-phenethyl-ammonium Formula: C20H28NO2+ MolecularWeight: 314.44182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OCC(C[NH2+]CCC2=CC=CC=C2)O

Isomeric SMILES

CC(C)C1=CC=CC=C1OC[C@@H](C[NH2+]CCC2=CC=CC=C2)O

InChI

InChI=1S/C20H27NO2/c1-16(2)19-10-6-7-11-20(19)23-15-18(22)14-21-13-12-17-8-4-3-5-9-17/h3-11,16,18,21-22H,12-15H2,1-2H3/p+1/t18-/m1/s1