[(2R)-2-oxidanyl-2-[4-(2,4,6-trimethylphenoxy)phenyl]ethyl]-propan-2-yl-azanium

Systemtic Name: [(2R)-2-oxidanyl-2-[4-(2,4,6-trimethylphenoxy)phenyl]ethyl]-propan-2-yl-azanium Openeye Name: [(2R)-2-hydroxy-2-[4-(2,4,6-trimethylphenoxy)phenyl]ethyl]-isopropyl-ammonium CAS Name: [(2R)-2-hydroxy-2-[4-(2,4,6-trimethylphenoxy)phenyl]ethyl]-propan-2-ylammonium IUPAC Name: [(2R)-2-hydroxy-2-[4-(2,4,6-trimethylphenoxy)phenyl]ethyl]-propan-2-ylazanium Traditional Name: [(2R)-2-hydroxy-2-[4-(2,4,6-trimethylphenoxy)phenyl]ethyl]-isopropyl-ammonium Formula: C20H28NO2+ MolecularWeight: 314.44182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OC2=CC=C(C=C2)C(C[NH2+]C(C)C)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OC2=CC=C(C=C2)[C@H](C[NH2+]C(C)C)O)C

InChI

InChI=1S/C20H27NO2/c1-13(2)21-12-19(22)17-6-8-18(9-7-17)23-20-15(4)10-14(3)11-16(20)5/h6-11,13,19,21-22H,12H2,1-5H3/p+1/t19-/m0/s1