N-[4-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]carbonylphenyl]-2-methyl-propanamide

Systemtic Name: N-[4-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]carbonylphenyl]-2-methyl-propanamide Openeye Name: N-[4-[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazine-1-carbonyl]phenyl]-2-methyl-propanamide CAS Name: N-[4-[[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]-oxomethyl]phenyl]-2-methylpropanamide IUPAC Name: N-[4-[4-[(2-chloro-6-fluorophenyl)methyl]piperazine-1-carbonyl]phenyl]-2-methylpropanamide Traditional Name: N-[4-[4-(2-chloro-6-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=CC=C3Cl)F

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)F

InChI

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