4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-N-(3-chloranyl-4-methyl-phenyl)piperazine-1-carboxamide

Systemtic Name: 4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-N-(3-chloranyl-4-methyl-phenyl)piperazine-1-carboxamide Openeye Name: 4-[(2-chloro-4-fluoro-phenyl)methyl]-N-(3-chloro-4-methyl-phenyl)piperazine-1-carboxamide CAS Name: 4-[(2-chloro-4-fluorophenyl)methyl]-N-(3-chloro-4-methylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[(2-chloro-4-fluorophenyl)methyl]-N-(3-chloro-4-methylphenyl)piperazine-1-carboxamide Traditional Name: 4-(2-chloro-4-fluoro-benzyl)-N-(3-chloro-4-methyl-phenyl)piperazine-1-carboxamide Formula: C19H20Cl2FN3O MolecularWeight: 396.286003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl)Cl

InChI

InChI=1S/C19H20Cl2FN3O/c1-13-2-5-16(11-17(13)20)23-19(26)25-8-6-24(7-9-25)12-14-3-4-15(22)10-18(14)21/h2-5,10-11H,6-9,12H2,1H3,(H,23,26)