4-butoxy-N-[5-chloranyl-2-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]phenyl]benzamide

Systemtic Name: 4-butoxy-N-[5-chloranyl-2-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]phenyl]benzamide Openeye Name: 4-butoxy-N-[5-chloro-2-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 4-butoxy-N-[5-chloro-2-[4-[(2-fluorophenyl)-oxomethyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 4-butoxy-N-[5-chloro-2-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 4-butoxy-N-[5-chloro-2-[4-(2-fluorobenzoyl)piperazino]phenyl]benzamide Formula: C28H29ClFN3O3 MolecularWeight: 509.999563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)Cl)N3CCN(CC3)C(=O)C4=CC=CC=C4F

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)Cl)N3CCN(CC3)C(=O)C4=CC=CC=C4F

InChI

InChI=1S/C28H29ClFN3O3/c1-2-3-18-36-22-11-8-20(9-12-22)27(34)31-25-19-21(29)10-13-26(25)32-14-16-33(17-15-32)28(35)23-6-4-5-7-24(23)30/h4-13,19H,2-3,14-18H2,1H3,(H,31,34)