2-[2,6-bis(4-bromophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-bromanyl-phenol

Systemtic Name: 2-[2,6-bis(4-bromophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-bromanyl-phenol Openeye Name: 2-[2,6-bis(4-bromophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-bromo-phenol CAS Name: 2-[2,6-bis(4-bromophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-bromophenol IUPAC Name: 2-[2,6-bis(4-bromophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-bromophenol Traditional Name: 2-[2,6-bis(4-bromophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-bromo-phenol Formula: C22H18Br3N2O+ MolecularWeight: 566.10312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2[NH2+]C(C=C(N2)C3=CC=C(C=C3)Br)C4=C(C=CC(=C4)Br)O)Br

Isomeric SMILES

C1=CC(=CC=C1C2[NH2+]C(C=C(N2)C3=CC=C(C=C3)Br)C4=C(C=CC(=C4)Br)O)Br

InChI

InChI=1S/C22H17Br3N2O/c23-15-5-1-13(2-6-15)19-12-20(18-11-17(25)9-10-21(18)28)27-22(26-19)14-3-7-16(24)8-4-14/h1-12,20,22,26-28H/p+1