2-[2-(5-bromanyl-2-fluoranyl-phenyl)-6-(4-ethylphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-chloranyl-phenol

Systemtic Name: 2-[2-(5-bromanyl-2-fluoranyl-phenyl)-6-(4-ethylphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-chloranyl-phenol Openeye Name: 2-[2-(5-bromo-2-fluoro-phenyl)-6-(4-ethylphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-chloro-phenol CAS Name: 2-[2-(5-bromo-2-fluorophenyl)-6-(4-ethylphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-chlorophenol IUPAC Name: 2-[2-(5-bromo-2-fluorophenyl)-6-(4-ethylphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-chlorophenol Traditional Name: 2-[2-(5-bromo-2-fluoro-phenyl)-6-(4-ethylphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]-4-chloro-phenol Formula: C24H22BrClFN2O+ MolecularWeight: 488.799683

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC([NH2+]C(N2)C3=C(C=CC(=C3)Br)F)C4=C(C=CC(=C4)Cl)O

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CC([NH2+]C(N2)C3=C(C=CC(=C3)Br)F)C4=C(C=CC(=C4)Cl)O

InChI

InChI=1S/C24H21BrClFN2O/c1-2-14-3-5-15(6-4-14)21-13-22(19-12-17(26)8-10-23(19)30)29-24(28-21)18-11-16(25)7-9-20(18)27/h3-13,22,24,28-30H,2H2,1H3/p+1