N-[(3-chloranyl-4-methoxy-phenyl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide

Systemtic Name: N-[(3-chloranyl-4-methoxy-phenyl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide Openeye Name: N-[(3-chloro-4-methoxy-phenyl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: N-[(3-chloro-4-methoxyphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: N-[(3-chloro-4-methoxyphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: N-(3-chloro-4-methoxy-benzyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C20H21ClF3N3O2 MolecularWeight: 427.84785

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C20H21ClF3N3O2/c1-29-18-6-5-14(11-17(18)21)13-25-19(28)27-9-7-26(8-10-27)16-4-2-3-15(12-16)20(22,23)24/h2-6,11-12H,7-10,13H2,1H3,(H,25,28)