[(1R,2R)-5-chloranyl-6-oxidanyl-1-phenyl-2,3-dihydro-1H-inden-2-yl]-dimethyl-azanium bromide

Systemtic Name: [(1R,2R)-5-chloranyl-6-oxidanyl-1-phenyl-2,3-dihydro-1H-inden-2-yl]-dimethyl-azanium bromide Openeye Name: [(1R,2R)-5-chloro-6-hydroxy-1-phenyl-indan-2-yl]-dimethyl-ammonium bromide CAS Name: [(1R,2R)-5-chloro-6-hydroxy-1-phenyl-2,3-dihydro-1H-inden-2-yl]-dimethylammonium bromide IUPAC Name: [(1R,2R)-5-chloro-6-hydroxy-1-phenyl-2,3-dihydro-1H-inden-2-yl]-dimethylazanium bromide Traditional Name: [(1R,2R)-5-chloro-6-hydroxy-1-phenyl-indan-2-yl]-dimethyl-ammonium bromide Formula: C17H19BrClNO MolecularWeight: 368.69586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1CC2=CC(=C(C=C2C1C3=CC=CC=C3)O)Cl.[Br-]

Isomeric SMILES

C[NH+](C)[C@@H]1CC2=CC(=C(C=C2[C@H]1C3=CC=CC=C3)O)Cl.[Br-]

InChI

InChI=1S/C17H18ClNO.BrH/c1-19(2)15-9-12-8-14(18)16(20)10-13(12)17(15)11-6-4-3-5-7-11;/h3-8,10,15,17,20H,9H2,1-2H3;1H/t15-,17-;/m1./s1