[4-[4-(3-bromanyl-4-methoxy-phenyl)carbonyl-2-fluoranyl-phenyl]piperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[4-(3-bromanyl-4-methoxy-phenyl)carbonyl-2-fluoranyl-phenyl]piperazin-1-yl]-phenyl-methanone Openeye Name: [4-[4-(3-bromo-4-methoxy-benzoyl)-2-fluoro-phenyl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[4-[(3-bromo-4-methoxyphenyl)-oxomethyl]-2-fluorophenyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[4-(3-bromo-4-methoxybenzoyl)-2-fluorophenyl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[4-(3-bromo-4-methoxy-benzoyl)-2-fluoro-phenyl]piperazino]-phenyl-methanone Formula: C25H22BrFN2O3 MolecularWeight: 497.356183

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)F)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)F)Br

InChI

InChI=1S/C25H22BrFN2O3/c1-32-23-10-8-18(15-20(23)26)24(30)19-7-9-22(21(27)16-19)28-11-13-29(14-12-28)25(31)17-5-3-2-4-6-17/h2-10,15-16H,11-14H2,1H3