9-[4-[4-[4-oxidanylidene-3-(phenylmethyl)phthalazin-6-yl]piperazin-1-yl]butyl]-N-[2,2,2-tris(fluoranyl)ethyl]fluorene-9-carboxamide

Systemtic Name: 9-[4-[4-[4-oxidanylidene-3-(phenylmethyl)phthalazin-6-yl]piperazin-1-yl]butyl]-N-[2,2,2-tris(fluoranyl)ethyl]fluorene-9-carboxamide Openeye Name: 9-[4-[4-(3-benzyl-4-oxo-phthalazin-6-yl)piperazin-1-yl]butyl]-N-(2,2,2-trifluoroethyl)fluorene-9-carboxamide CAS Name: 9-[4-[4-[4-oxo-3-(phenylmethyl)-6-phthalazinyl]-1-piperazinyl]butyl]-N-(2,2,2-trifluoroethyl)-9-fluorenecarboxamide IUPAC Name: 9-[4-[4-(3-benzyl-4-oxophthalazin-6-yl)piperazin-1-yl]butyl]-N-(2,2,2-trifluoroethyl)fluorene-9-carboxamide Traditional Name: 9-[4-[4-(3-benzyl-4-keto-phthalazin-6-yl)piperazino]butyl]-N-(2,2,2-trifluoroethyl)fluorene-9-carboxamide Formula: C39H38F3N5O2 MolecularWeight: 665.74653

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2(C3=CC=CC=C3C4=CC=CC=C42)C(=O)NCC(F)(F)F)C5=CC6=C(C=C5)C=NN(C6=O)CC7=CC=CC=C7

Isomeric SMILES

C1CN(CCN1CCCCC2(C3=CC=CC=C3C4=CC=CC=C42)C(=O)NCC(F)(F)F)C5=CC6=C(C=C5)C=NN(C6=O)CC7=CC=CC=C7

InChI

InChI=1S/C39H38F3N5O2/c40-39(41,42)27-43-37(49)38(34-14-6-4-12-31(34)32-13-5-7-15-35(32)38)18-8-9-19-45-20-22-46(23-21-45)30-17-16-29-25-44-47(36(48)33(29)24-30)26-28-10-2-1-3-11-28/h1-7,10-17,24-25H,8-9,18-23,26-27H2,(H,43,49)