2-[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-4-methoxy-phenyl]-1,4,5,6-tetrahydropyrimidine

Systemtic Name: 2-[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-4-methoxy-phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-4-methoxy-phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-4-methoxyphenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-4-methoxyphenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-4-methoxy-phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C20H23BrN2O2 MolecularWeight: 403.31282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=NCCCN2)CCC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=NCCCN2)CCC3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C20H23BrN2O2/c1-24-17-7-8-18(20-22-10-3-11-23-20)14(13-17)4-5-15-12-16(21)6-9-19(15)25-2/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,22,23)