N-[3,5-bis(trifluoromethyl)phenyl]-4-(3-methoxyphenyl)piperazine-1-carboxamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(3-methoxyphenyl)piperazine-1-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(3-methoxyphenyl)piperazine-1-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(3-methoxyphenyl)-1-piperazinecarboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(3-methoxyphenyl)piperazine-1-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(3-methoxyphenyl)piperazine-1-carboxamide Formula: C20H19F6N3O2 MolecularWeight: 447.374179

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C20H19F6N3O2/c1-31-17-4-2-3-16(12-17)28-5-7-29(8-6-28)18(30)27-15-10-13(19(21,22)23)9-14(11-15)20(24,25)26/h2-4,9-12H,5-8H2,1H3,(H,27,30)