2-[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-3-methoxy-phenyl]-1,4,5,6-tetrahydropyrimidine

Systemtic Name: 2-[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-3-methoxy-phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-3-methoxy-phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-methoxyphenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-methoxyphenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-3-methoxy-phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C20H23BrN2O2 MolecularWeight: 403.31282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CCC2=C(C=CC=C2OC)C3=NCCCN3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CCC2=C(C=CC=C2OC)C3=NCCCN3

InChI

InChI=1S/C20H23BrN2O2/c1-24-18-10-8-15(21)13-14(18)7-9-16-17(5-3-6-19(16)25-2)20-22-11-4-12-23-20/h3,5-6,8,10,13H,4,7,9,11-12H2,1-2H3,(H,22,23)