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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)Cl)N3CCN(CC3)C(=O)C4=CC=CC=C4F

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)Cl)N3CCN(CC3)C(=O)C4=CC=CC=C4F

InChI

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