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

Systemtic Name: 3-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]-3-sec-butoxy-benzamide CAS Name: 3-butan-2-yloxy-N-[5-chloro-2-[4-[(2-fluorophenyl)-oxomethyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 3-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]-3-sec-butoxy-benzamide Formula: C28H29ClFN3O3 MolecularWeight: 509.999563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(C)OC1=CC=CC(=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)36-22-8-6-7-20(17-22)27(34)31-25-18-21(29)11-12-26(25)32-13-15-33(16-14-32)28(35)23-9-4-5-10-24(23)30/h4-12,17-19H,3,13-16H2,1-2H3,(H,31,34)