2-[2-(3-bromanyl-4-methoxy-phenyl)-6-(4-chlorophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-6-ethoxy-phenol

Systemtic Name: 2-[2-(3-bromanyl-4-methoxy-phenyl)-6-(4-chlorophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-6-ethoxy-phenol Openeye Name: 2-[2-(3-bromo-4-methoxy-phenyl)-6-(4-chlorophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-6-ethoxy-phenol CAS Name: 2-[2-(3-bromo-4-methoxyphenyl)-6-(4-chlorophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-6-ethoxyphenol IUPAC Name: 2-[2-(3-bromo-4-methoxyphenyl)-6-(4-chlorophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-6-ethoxyphenol Traditional Name: 2-[2-(3-bromo-4-methoxy-phenyl)-6-(4-chlorophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-6-ethoxy-phenol Formula: C25H25BrClN2O3+ MolecularWeight: 516.8346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H24BrClN2O3/c1-3-32-23-6-4-5-18(24(23)30)21-14-20(15-7-10-17(27)11-8-15)28-25(29-21)16-9-12-22(31-2)19(26)13-16/h4-14,21,25,28-30H,3H2,1-2H3/p+1