[[(4R)-4-(4-bromophenyl)-3-cyano-4H-benzo[h]chromen-2-yl]amino]methylidene-dimethyl-azanium

Systemtic Name: [[(4R)-4-(4-bromophenyl)-3-cyano-4H-benzo[h]chromen-2-yl]amino]methylidene-dimethyl-azanium Openeye Name: [[(4R)-4-(4-bromophenyl)-3-cyano-4H-benzo[h]chromen-2-yl]amino]methylene-dimethyl-ammonium CAS Name: [[(4R)-4-(4-bromophenyl)-3-cyano-4H-benzo[h][1]benzopyran-2-yl]amino]methylidene-dimethylammonium IUPAC Name: [[(4R)-4-(4-bromophenyl)-3-cyano-4H-benzo[h]chromen-2-yl]amino]methylidene-dimethylazanium Traditional Name: [[(4R)-4-(4-bromophenyl)-3-cyano-4H-benzo[h]chromen-2-yl]amino]methylene-dimethyl-ammonium Formula: C23H19BrN3O+ MolecularWeight: 433.32046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](=CNC1=C(C(C2=C(O1)C3=CC=CC=C3C=C2)C4=CC=C(C=C4)Br)C#N)C

Isomeric SMILES

C[N+](=CNC1=C([C@@H](C2=C(O1)C3=CC=CC=C3C=C2)C4=CC=C(C=C4)Br)C#N)C

InChI

InChI=1S/C23H18BrN3O/c1-27(2)14-26-23-20(13-25)21(16-7-10-17(24)11-8-16)19-12-9-15-5-3-4-6-18(15)22(19)28-23/h3-12,14,21H,1-2H3/p+1/t21-/m1/s1