1-[4-(3-chloranyl-4-ethoxy-5-methoxy-phenyl)carbonylpiperazin-1-yl]-2-(4-fluorophenyl)ethanone

Systemtic Name: 1-[4-(3-chloranyl-4-ethoxy-5-methoxy-phenyl)carbonylpiperazin-1-yl]-2-(4-fluorophenyl)ethanone Openeye Name: 1-[4-(3-chloro-4-ethoxy-5-methoxy-benzoyl)piperazin-1-yl]-2-(4-fluorophenyl)ethanone CAS Name: 1-[4-[(3-chloro-4-ethoxy-5-methoxyphenyl)-oxomethyl]-1-piperazinyl]-2-(4-fluorophenyl)ethanone IUPAC Name: 1-[4-(3-chloro-4-ethoxy-5-methoxybenzoyl)piperazin-1-yl]-2-(4-fluorophenyl)ethanone Traditional Name: 1-[4-(3-chloro-4-ethoxy-5-methoxy-benzoyl)piperazino]-2-(4-fluorophenyl)ethanone Formula: C22H24ClFN2O4 MolecularWeight: 434.888363

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)C(=O)CC3=CC=C(C=C3)F)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)C(=O)CC3=CC=C(C=C3)F)OC

InChI

InChI=1S/C22H24ClFN2O4/c1-3-30-21-18(23)13-16(14-19(21)29-2)22(28)26-10-8-25(9-11-26)20(27)12-15-4-6-17(24)7-5-15/h4-7,13-14H,3,8-12H2,1-2H3