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

Systemtic Name: 4-bromanyl-2-[2-(4-bromophenyl)-6-(3-methoxyphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Openeye Name: 4-bromo-2-[2-(4-bromophenyl)-6-(3-methoxyphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol CAS Name: 4-bromo-2-[2-(4-bromophenyl)-6-(3-methoxyphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol IUPAC Name: 4-bromo-2-[2-(4-bromophenyl)-6-(3-methoxyphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Traditional Name: 4-bromo-2-[2-(4-bromophenyl)-6-(3-methoxyphenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Formula: C23H21Br2N2O2+ MolecularWeight: 517.23304

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC([NH2+]C(N2)C3=CC=C(C=C3)Br)C4=C(C=CC(=C4)Br)O

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC([NH2+]C(N2)C3=CC=C(C=C3)Br)C4=C(C=CC(=C4)Br)O

InChI

InChI=1S/C23H20Br2N2O2/c1-29-18-4-2-3-15(11-18)20-13-21(19-12-17(25)9-10-22(19)28)27-23(26-20)14-5-7-16(24)8-6-14/h2-13,21,23,26-28H,1H3/p+1