5-bromanyl-N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]-2-methoxy-3-methyl-benzamide

Systemtic Name: 5-bromanyl-N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]-2-methoxy-3-methyl-benzamide Openeye Name: 5-bromo-N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]-2-methoxy-3-methyl-benzamide CAS Name: 5-bromo-N-[4-[4-[(2-fluorophenyl)methyl]-1-piperazinyl]phenyl]-2-methoxy-3-methylbenzamide IUPAC Name: 5-bromo-N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]-2-methoxy-3-methylbenzamide Traditional Name: 5-bromo-N-[4-[4-(2-fluorobenzyl)piperazino]phenyl]-2-methoxy-3-methyl-benzamide Formula: C26H27BrFN3O2 MolecularWeight: 512.413883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4F)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4F)OC

InChI

InChI=1S/C26H27BrFN3O2/c1-18-15-20(27)16-23(25(18)33-2)26(32)29-21-7-9-22(10-8-21)31-13-11-30(12-14-31)17-19-5-3-4-6-24(19)28/h3-10,15-16H,11-14,17H2,1-2H3,(H,29,32)