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

Systemtic Name: [(1R,2R)-6-chloranyl-5-oxidanyl-1-phenyl-2,3-dihydro-1H-inden-2-yl]-methyl-azanium bromide Openeye Name: [(1R,2R)-6-chloro-5-hydroxy-1-phenyl-indan-2-yl]-methyl-ammonium bromide CAS Name: [(1R,2R)-6-chloro-5-hydroxy-1-phenyl-2,3-dihydro-1H-inden-2-yl]-methylammonium bromide IUPAC Name: [(1R,2R)-6-chloro-5-hydroxy-1-phenyl-2,3-dihydro-1H-inden-2-yl]-methylazanium bromide Traditional Name: [(1R,2R)-6-chloro-5-hydroxy-1-phenyl-indan-2-yl]-methyl-ammonium bromide Formula: C16H17BrClNO MolecularWeight: 354.66928

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]C1CC2=CC(=C(C=C2C1C3=CC=CC=C3)Cl)O.[Br-]

Isomeric SMILES

C[NH2+][C@@H]1CC2=CC(=C(C=C2[C@H]1C3=CC=CC=C3)Cl)O.[Br-]

InChI

InChI=1S/C16H16ClNO.BrH/c1-18-14-7-11-8-15(19)13(17)9-12(11)16(14)10-5-3-2-4-6-10;/h2-6,8-9,14,16,18-19H,7H2,1H3;1H/t14-,16-;/m1./s1