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

Systemtic Name: 4-bromanyl-2-[6-(4-ethylphenyl)-2-(3-fluorophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Openeye Name: 4-bromo-2-[6-(4-ethylphenyl)-2-(3-fluorophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol CAS Name: 4-bromo-2-[6-(4-ethylphenyl)-2-(3-fluorophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol IUPAC Name: 4-bromo-2-[6-(4-ethylphenyl)-2-(3-fluorophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Traditional Name: 4-bromo-2-[6-(4-ethylphenyl)-2-(3-fluorophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Formula: C24H23BrFN2O+ MolecularWeight: 454.354623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22BrFN2O/c1-2-15-6-8-16(9-7-15)21-14-22(20-13-18(25)10-11-23(20)29)28-24(27-21)17-4-3-5-19(26)12-17/h3-14,22,24,27-29H,2H2,1H3/p+1