(4-butoxy-3-methoxy-phenyl)-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]methanone

Systemtic Name: (4-butoxy-3-methoxy-phenyl)-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]methanone Openeye Name: (4-butoxy-3-methoxy-phenyl)-[4-(5-chloro-2-fluoro-benzoyl)piperazin-1-yl]methanone CAS Name: (4-butoxy-3-methoxyphenyl)-[4-[(5-chloro-2-fluorophenyl)-oxomethyl]-1-piperazinyl]methanone IUPAC Name: (4-butoxy-3-methoxyphenyl)-[4-(5-chloro-2-fluorobenzoyl)piperazin-1-yl]methanone Traditional Name: (4-butoxy-3-methoxy-phenyl)-[4-(5-chloro-2-fluoro-benzoyl)piperazino]methanone Formula: C23H26ClFN2O4 MolecularWeight: 448.914943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)Cl)F)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)Cl)F)OC

InChI

InChI=1S/C23H26ClFN2O4/c1-3-4-13-31-20-8-5-16(14-21(20)30-2)22(28)26-9-11-27(12-10-26)23(29)18-15-17(24)6-7-19(18)25/h5-8,14-15H,3-4,9-13H2,1-2H3