N-(4-bromanyl-2-methyl-phenyl)-2-[4-(4-phenylmethoxyphenyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[4-(4-phenylmethoxyphenyl)piperazin-1-yl]ethanamide Openeye Name: 2-[4-(4-benzyloxyphenyl)piperazin-1-yl]-N-(4-bromo-2-methyl-phenyl)acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[4-(4-phenylmethoxyphenyl)-1-piperazinyl]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[4-(4-phenylmethoxyphenyl)piperazin-1-yl]acetamide Traditional Name: 2-[4-(4-benzoxyphenyl)piperazino]-N-(4-bromo-2-methyl-phenyl)acetamide Formula: C26H28BrN3O2 MolecularWeight: 494.42342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN2CCN(CC2)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN2CCN(CC2)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H28BrN3O2/c1-20-17-22(27)7-12-25(20)28-26(31)18-29-13-15-30(16-14-29)23-8-10-24(11-9-23)32-19-21-5-3-2-4-6-21/h2-12,17H,13-16,18-19H2,1H3,(H,28,31)