butyl-[(2R)-2-oxidanyl-2-(4-phenylmethoxyphenyl)propyl]azanium

Systemtic Name: butyl-[(2R)-2-oxidanyl-2-(4-phenylmethoxyphenyl)propyl]azanium Openeye Name: [(2R)-2-(4-benzyloxyphenyl)-2-hydroxy-propyl]-butyl-ammonium CAS Name: butyl-[(2R)-2-hydroxy-2-(4-phenylmethoxyphenyl)propyl]ammonium IUPAC Name: butyl-[(2R)-2-hydroxy-2-(4-phenylmethoxyphenyl)propyl]azanium Traditional Name: [(2R)-2-(4-benzoxyphenyl)-2-hydroxy-propyl]-butyl-ammonium Formula: C20H28NO2+ MolecularWeight: 314.44182

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]CC(C)(C1=CC=C(C=C1)OCC2=CC=CC=C2)O

Isomeric SMILES

CCCC[NH2+]C[C@@](C)(C1=CC=C(C=C1)OCC2=CC=CC=C2)O

InChI

InChI=1S/C20H27NO2/c1-3-4-14-21-16-20(2,22)18-10-12-19(13-11-18)23-15-17-8-6-5-7-9-17/h5-13,21-22H,3-4,14-16H2,1-2H3/p+1/t20-/m0/s1