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

Systemtic Name: 4-bromanyl-2-[6-(3-methoxyphenyl)-2-propan-2-yl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Openeye Name: 4-bromo-2-[2-isopropyl-6-(3-methoxyphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol CAS Name: 4-bromo-2-[6-(3-methoxyphenyl)-2-propan-2-yl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol IUPAC Name: 4-bromo-2-[6-(3-methoxyphenyl)-2-propan-2-yl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Traditional Name: 4-bromo-2-[2-isopropyl-6-(3-methoxyphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Formula: C20H24BrN2O2+ MolecularWeight: 404.32076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1[NH2+]C(C=C(N1)C2=CC(=CC=C2)OC)C3=C(C=CC(=C3)Br)O

Isomeric SMILES

CC(C)C1[NH2+]C(C=C(N1)C2=CC(=CC=C2)OC)C3=C(C=CC(=C3)Br)O

InChI

InChI=1S/C20H23BrN2O2/c1-12(2)20-22-17(13-5-4-6-15(9-13)25-3)11-18(23-20)16-10-14(21)7-8-19(16)24/h4-12,18,20,22-24H,1-3H3/p+1