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4-(pentyliminomethyl)-2-[3-(trifluoromethyl)phenyl]-4H-isoquinoline-1,3-dione
4-(pentyliminomethyl)-2-[3-(trifluoromethyl)phenyl]-4H-isoquinoline-1,3-dione
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Descriptors Computed from Structure
Canonical SMILES:
CCCCCN=CC1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC(=C3)C(F)(F)F
Isomeric SMILES
CCCCCN=CC1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC(=C3)C(F)(F)F
InChI
InChI=1S/C22H21F3N2O2/c1-2-3-6-12-26-14-19-17-10-4-5-11-18(17)20(28)27(21(19)29)16-9-7-8-15(13-16)22(23,24)25/h4-5,7-11,13-14,19H,2-3,6,12H2,1H3
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