N-[2-oxidanylidene-2-[4-[4-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-[4-[4-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]ethyl]adamantane-1-carboxamide Openeye Name: N-[2-oxo-2-[4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl]ethyl]adamantane-1-carboxamide CAS Name: N-[2-oxo-2-[4-[oxo-[4-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]ethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-oxo-2-[4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl]ethyl]adamantane-1-carboxamide Traditional Name: N-[2-keto-2-[4-[4-(trifluoromethyl)benzoyl]piperazino]ethyl]adamantane-1-carboxamide Formula: C25H30F3N3O3 MolecularWeight: 477.51921

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3)C(=O)C5=CC=C(C=C5)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3)C(=O)C5=CC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C25H30F3N3O3/c26-25(27,28)20-3-1-19(2-4-20)22(33)31-7-5-30(6-8-31)21(32)15-29-23(34)24-12-16-9-17(13-24)11-18(10-16)14-24/h1-4,16-18H,5-15H2,(H,29,34)