5-phenylmethoxy-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-pyran-4-one

Systemtic Name: 5-phenylmethoxy-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-pyran-4-one Openeye Name: 5-benzyloxy-2-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]pyran-4-one CAS Name: 2-[oxo-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]-5-phenylmethoxy-4-pyranone IUPAC Name: 5-phenylmethoxy-2-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]pyran-4-one Traditional Name: 5-benzoxy-2-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]pyran-4-one Formula: C24H21F3N2O4 MolecularWeight: 458.42975

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)C3=CC(=O)C(=CO3)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)C3=CC(=O)C(=CO3)OCC4=CC=CC=C4

InChI

InChI=1S/C24H21F3N2O4/c25-24(26,27)18-7-4-8-19(13-18)28-9-11-29(12-10-28)23(31)21-14-20(30)22(16-33-21)32-15-17-5-2-1-3-6-17/h1-8,13-14,16H,9-12,15H2