N-[[4-oxidanyl-3,5-bis(pyrrolidin-1-ylmethyl)phenyl]methyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[[4-oxidanyl-3,5-bis(pyrrolidin-1-ylmethyl)phenyl]methyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[[4-hydroxy-3,5-bis(pyrrolidin-1-ylmethyl)phenyl]methyl]-3-(trifluoromethyl)benzamide CAS Name: N-[[4-hydroxy-3,5-bis(1-pyrrolidinylmethyl)phenyl]methyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[[4-hydroxy-3,5-bis(pyrrolidin-1-ylmethyl)phenyl]methyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[4-hydroxy-3,5-bis(pyrrolidinomethyl)benzyl]-3-(trifluoromethyl)benzamide Formula: C25H30F3N3O2 MolecularWeight: 461.51981

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC(=CC(=C2O)CN3CCCC3)CNC(=O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1CCN(C1)CC2=CC(=CC(=C2O)CN3CCCC3)CNC(=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C25H30F3N3O2/c26-25(27,28)22-7-5-6-19(14-22)24(33)29-15-18-12-20(16-30-8-1-2-9-30)23(32)21(13-18)17-31-10-3-4-11-31/h5-7,12-14,32H,1-4,8-11,15-17H2,(H,29,33)