N-(5-acetamido-2-methoxy-phenyl)-2-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(5-acetamido-2-methoxy-phenyl)-2-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-(5-acetamido-2-methoxy-phenyl)-2-[4-[(2-chloro-4-fluoro-phenyl)methyl]piperazin-1-yl]acetamide CAS Name: N-(5-acetamido-2-methoxyphenyl)-2-[4-[(2-chloro-4-fluorophenyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(5-acetamido-2-methoxyphenyl)-2-[4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl]acetamide Traditional Name: N-(5-acetamido-2-methoxy-phenyl)-2-[4-(2-chloro-4-fluoro-benzyl)piperazino]acetamide Formula: C22H26ClFN4O3 MolecularWeight: 448.918243

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CN2CCN(CC2)CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CN2CCN(CC2)CC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C22H26ClFN4O3/c1-15(29)25-18-5-6-21(31-2)20(12-18)26-22(30)14-28-9-7-27(8-10-28)13-16-3-4-17(24)11-19(16)23/h3-6,11-12H,7-10,13-14H2,1-2H3,(H,25,29)(H,26,30)