dimethyl-[(2S)-2-oxidanyl-3-[1,3,6-tris(bromanyl)carbazol-9-yl]propyl]azanium

Systemtic Name: dimethyl-[(2S)-2-oxidanyl-3-[1,3,6-tris(bromanyl)carbazol-9-yl]propyl]azanium Openeye Name: [(2S)-2-hydroxy-3-(1,3,6-tribromocarbazol-9-yl)propyl]-dimethyl-ammonium CAS Name: [(2S)-2-hydroxy-3-(1,3,6-tribromo-9-carbazolyl)propyl]-dimethylammonium IUPAC Name: [(2S)-2-hydroxy-3-(1,3,6-tribromocarbazol-9-yl)propyl]-dimethylazanium Traditional Name: [(2S)-2-hydroxy-3-(1,3,6-tribromocarbazol-9-yl)propyl]-dimethyl-ammonium Formula: C17H18Br3N2O+ MolecularWeight: 506.04962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(CN1C2=C(C=C(C=C2)Br)C3=CC(=CC(=C31)Br)Br)O

Isomeric SMILES

C[NH+](C)C[C@H](CN1C2=C(C=C(C=C2)Br)C3=CC(=CC(=C31)Br)Br)O

InChI

InChI=1S/C17H17Br3N2O/c1-21(2)8-12(23)9-22-16-4-3-10(18)5-13(16)14-6-11(19)7-15(20)17(14)22/h3-7,12,23H,8-9H2,1-2H3/p+1/t12-/m1/s1