1-[3-fluoranyl-4-[4-(3,4,5-triethoxyphenyl)carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[3-fluoranyl-4-[4-(3,4,5-triethoxyphenyl)carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[3-fluoro-4-[4-(3,4,5-triethoxybenzoyl)piperazin-1-yl]phenyl]ethanone CAS Name: 1-[3-fluoro-4-[4-[oxo-(3,4,5-triethoxyphenyl)methyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[3-fluoro-4-[4-(3,4,5-triethoxybenzoyl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[3-fluoro-4-[4-(3,4,5-triethoxybenzoyl)piperazino]phenyl]ethanone Formula: C25H31FN2O5 MolecularWeight: 458.522443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)C)F

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)C)F

InChI

InChI=1S/C25H31FN2O5/c1-5-31-22-15-19(16-23(32-6-2)24(22)33-7-3)25(30)28-12-10-27(11-13-28)21-9-8-18(17(4)29)14-20(21)26/h8-9,14-16H,5-7,10-13H2,1-4H3