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

Systemtic Name: 2-[6-(4-bromophenyl)-2-(2-methylphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-6-ethoxy-phenol Openeye Name: 2-[6-(4-bromophenyl)-2-(o-tolyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-6-ethoxy-phenol CAS Name: 2-[6-(4-bromophenyl)-2-(2-methylphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-6-ethoxyphenol IUPAC Name: 2-[6-(4-bromophenyl)-2-(2-methylphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-6-ethoxyphenol Traditional Name: 2-[6-(4-bromophenyl)-2-(o-tolyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-6-ethoxy-phenol Formula: C25H26BrN2O2+ MolecularWeight: 466.39014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)C2C=C(NC([NH2+]2)C3=CC=CC=C3C)C4=CC=C(C=C4)Br

Isomeric SMILES

CCOC1=CC=CC(=C1O)C2C=C(NC([NH2+]2)C3=CC=CC=C3C)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H25BrN2O2/c1-3-30-23-10-6-9-20(24(23)29)22-15-21(17-11-13-18(26)14-12-17)27-25(28-22)19-8-5-4-7-16(19)2/h4-15,22,25,27-29H,3H2,1-2H3/p+1