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

Systemtic Name: 2-[2,6-bis(4-methylphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-bromanyl-phenol Openeye Name: 2-[2,6-bis(p-tolyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-bromo-phenol CAS Name: 2-[2,6-bis(4-methylphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-bromophenol IUPAC Name: 2-[2,6-bis(4-methylphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-bromophenol Traditional Name: 2-[2,6-bis(p-tolyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-bromo-phenol Formula: C24H24BrN2O+ MolecularWeight: 436.36416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2[NH2+]C(C=C(N2)C3=CC=C(C=C3)C)C4=C(C=CC(=C4)Br)O

Isomeric SMILES

CC1=CC=C(C=C1)C2[NH2+]C(C=C(N2)C3=CC=C(C=C3)C)C4=C(C=CC(=C4)Br)O

InChI

InChI=1S/C24H23BrN2O/c1-15-3-7-17(8-4-15)21-14-22(20-13-19(25)11-12-23(20)28)27-24(26-21)18-9-5-16(2)6-10-18/h3-14,22,24,26-28H,1-2H3/p+1