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

Systemtic Name: [3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl-[(1S,2R)-1-oxidanyl-1-phenyl-propan-2-yl]azanium Openeye Name: [(1R,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]-[[3-methoxy-4-(2-thienylmethoxy)phenyl]methyl]ammonium CAS Name: [(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]ammonium IUPAC Name: [(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium Traditional Name: [(1R,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]-[3-methoxy-4-(2-thenyloxy)benzyl]ammonium Formula: C22H26NO3S+ MolecularWeight: 384.51174

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO3S/c1-16(22(24)18-7-4-3-5-8-18)23-14-17-10-11-20(21(13-17)25-2)26-15-19-9-6-12-27-19/h3-13,16,22-24H,14-15H2,1-2H3/p+1/t16-,22-/m1/s1