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

Systemtic Name: 2-[6-(3-bromophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Openeye Name: 2-[6-(3-bromophenyl)-2-(p-tolyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol CAS Name: 2-[6-(3-bromophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol IUPAC Name: 2-[6-(3-bromophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Traditional Name: 2-[6-(3-bromophenyl)-2-(p-tolyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Formula: C23H22BrN2O+ MolecularWeight: 422.33758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2[NH2+]C(C=C(N2)C3=CC(=CC=C3)Br)C4=CC=CC=C4O

Isomeric SMILES

CC1=CC=C(C=C1)C2[NH2+]C(C=C(N2)C3=CC(=CC=C3)Br)C4=CC=CC=C4O

InChI

InChI=1S/C23H21BrN2O/c1-15-9-11-16(12-10-15)23-25-20(17-5-4-6-18(24)13-17)14-21(26-23)19-7-2-3-8-22(19)27/h2-14,21,23,25-27H,1H3/p+1