(5-chloranyl-2-methoxy-phenyl)methyl-[(1S,2R)-1-oxidanyl-1-phenyl-propan-2-yl]azanium

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl-[(1S,2R)-1-oxidanyl-1-phenyl-propan-2-yl]azanium Openeye Name: (5-chloro-2-methoxy-phenyl)methyl-[(1R,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]ammonium CAS Name: (5-chloro-2-methoxyphenyl)methyl-[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]ammonium IUPAC Name: (5-chloro-2-methoxyphenyl)methyl-[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]azanium Traditional Name: (5-chloro-2-methoxy-benzyl)-[(1R,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]ammonium Formula: C17H21ClNO2+ MolecularWeight: 306.80714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)O)[NH2+]CC2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

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

InChI

InChI=1S/C17H20ClNO2/c1-12(17(20)13-6-4-3-5-7-13)19-11-14-10-15(18)8-9-16(14)21-2/h3-10,12,17,19-20H,11H2,1-2H3/p+1/t12-,17-/m1/s1