butyl-[(2R)-2-[4-(2,5-dimethylphenoxy)phenyl]-2-oxidanyl-ethyl]azanium

Systemtic Name: butyl-[(2R)-2-[4-(2,5-dimethylphenoxy)phenyl]-2-oxidanyl-ethyl]azanium Openeye Name: butyl-[(2R)-2-[4-(2,5-dimethylphenoxy)phenyl]-2-hydroxy-ethyl]ammonium CAS Name: butyl-[(2R)-2-[4-(2,5-dimethylphenoxy)phenyl]-2-hydroxyethyl]ammonium IUPAC Name: butyl-[(2R)-2-[4-(2,5-dimethylphenoxy)phenyl]-2-hydroxyethyl]azanium Traditional Name: butyl-[(2R)-2-[4-(2,5-dimethylphenoxy)phenyl]-2-hydroxy-ethyl]ammonium Formula: C20H28NO2+ MolecularWeight: 314.44182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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