[(1R,2R)-1-(3-chloranyl-4-phenylmethoxy-phenyl)-3-ethoxy-1-oxidanyl-3-oxidanylidene-propan-2-yl]azanium chloride

Systemtic Name: [(1R,2R)-1-(3-chloranyl-4-phenylmethoxy-phenyl)-3-ethoxy-1-oxidanyl-3-oxidanylidene-propan-2-yl]azanium chloride Openeye Name: [(1R)-1-[(R)-(4-benzyloxy-3-chloro-phenyl)-hydroxy-methyl]-2-ethoxy-2-oxo-ethyl]ammonium chloride CAS Name: [(1R,2R)-1-(3-chloro-4-phenylmethoxyphenyl)-3-ethoxy-1-hydroxy-3-oxopropan-2-yl]ammonium chloride IUPAC Name: [(1R,2R)-1-(3-chloro-4-phenylmethoxyphenyl)-3-ethoxy-1-hydroxy-3-oxopropan-2-yl]azanium chloride Traditional Name: [(1R)-1-[(R)-(4-benzoxy-3-chloro-phenyl)-hydroxy-methyl]-2-ethoxy-2-keto-ethyl]ammonium chloride Formula: C18H21Cl2NO4 MolecularWeight: 386.26964

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC(=C(C=C1)OCC2=CC=CC=C2)Cl)O)[NH3+].[Cl-]

Isomeric SMILES

CCOC(=O)[C@@H]([C@@H](C1=CC(=C(C=C1)OCC2=CC=CC=C2)Cl)O)[NH3+].[Cl-]

InChI

InChI=1S/C18H20ClNO4.ClH/c1-2-23-18(22)16(20)17(21)13-8-9-15(14(19)10-13)24-11-12-6-4-3-5-7-12;/h3-10,16-17,21H,2,11,20H2,1H3;1H/t16-,17-;/m1./s1