[(1S,2R)-1-oxidanyl-1-phenyl-propan-2-yl]-[[4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium

Systemtic Name: [(1S,2R)-1-oxidanyl-1-phenyl-propan-2-yl]-[[4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium Openeye Name: [(1R,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]-[[4-(2-thienylmethoxy)phenyl]methyl]ammonium CAS Name: [(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]-[[4-(thiophen-2-ylmethoxy)phenyl]methyl]ammonium IUPAC Name: [(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]-[[4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium Traditional Name: [(1R,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]-[4-(2-thenyloxy)benzyl]ammonium Formula: C21H24NO2S+ MolecularWeight: 354.48576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)O)[NH2+]CC2=CC=C(C=C2)OCC3=CC=CS3

Isomeric SMILES

C[C@H]([C@H](C1=CC=CC=C1)O)[NH2+]CC2=CC=C(C=C2)OCC3=CC=CS3

InChI

InChI=1S/C21H23NO2S/c1-16(21(23)18-6-3-2-4-7-18)22-14-17-9-11-19(12-10-17)24-15-20-8-5-13-25-20/h2-13,16,21-23H,14-15H2,1H3/p+1/t16-,21-/m1/s1