(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (3-bromanyl-5-ethoxy-4-methoxy-phenyl)-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone Openeye Name: (3-bromo-5-ethoxy-4-methoxy-phenyl)-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone CAS Name: (3-bromo-5-ethoxy-4-methoxyphenyl)-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (3-bromo-5-ethoxy-4-methoxyphenyl)-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (3-bromo-5-ethoxy-4-methoxy-phenyl)-[4-(3-fluoro-4-methoxy-benzyl)piperazino]methanone Formula: C22H26BrFN2O4 MolecularWeight: 481.355243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)CC3=CC(=C(C=C3)OC)F)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)CC3=CC(=C(C=C3)OC)F)Br)OC

InChI

InChI=1S/C22H26BrFN2O4/c1-4-30-20-13-16(12-17(23)21(20)29-3)22(27)26-9-7-25(8-10-26)14-15-5-6-19(28-2)18(24)11-15/h5-6,11-13H,4,7-10,14H2,1-3H3