N-[4-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]carbonylphenyl]-2-methyl-propanamide

Systemtic Name: N-[4-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]carbonylphenyl]-2-methyl-propanamide Openeye Name: N-[4-[4-[(2-chloro-4-fluoro-phenyl)methyl]piperazine-1-carbonyl]phenyl]-2-methyl-propanamide CAS Name: N-[4-[[4-[(2-chloro-4-fluorophenyl)methyl]-1-piperazinyl]-oxomethyl]phenyl]-2-methylpropanamide IUPAC Name: N-[4-[4-[(2-chloro-4-fluorophenyl)methyl]piperazine-1-carbonyl]phenyl]-2-methylpropanamide Traditional Name: N-[4-[4-(2-chloro-4-fluoro-benzyl)piperazine-1-carbonyl]phenyl]-2-methyl-propionamide Formula: C22H25ClFN3O2 MolecularWeight: 417.904203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C22H25ClFN3O2/c1-15(2)21(28)25-19-7-4-16(5-8-19)22(29)27-11-9-26(10-12-27)14-17-3-6-18(24)13-20(17)23/h3-8,13,15H,9-12,14H2,1-2H3,(H,25,28)