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

Systemtic Name: 2-[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-3-butoxy-phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-3-butoxy-phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-butoxyphenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-butoxyphenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-3-butoxy-phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C23H29BrN2O2 MolecularWeight: 445.39256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1CCC2=C(C=CC(=C2)Br)OC)C3=NCCCN3

Isomeric SMILES

CCCCOC1=CC=CC(=C1CCC2=C(C=CC(=C2)Br)OC)C3=NCCCN3

InChI

InChI=1S/C23H29BrN2O2/c1-3-4-15-28-22-8-5-7-20(23-25-13-6-14-26-23)19(22)11-9-17-16-18(24)10-12-21(17)27-2/h5,7-8,10,12,16H,3-4,6,9,11,13-15H2,1-2H3,(H,25,26)