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3-phenanthren-2-yl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carbaldehyde
3-phenanthren-2-yl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carbaldehyde
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC=C2C(=C1)C=CC3=C2C=CC(=C3)C4=NN(C=C4C=O)C5=CC=CC(=C5)C(F)(F)F
Isomeric SMILES
C1=CC=C2C(=C1)C=CC3=C2C=CC(=C3)C4=NN(C=C4C=O)C5=CC=CC(=C5)C(F)(F)F
InChI
InChI=1S/C25H15F3N2O/c26-25(27,28)20-5-3-6-21(13-20)30-14-19(15-31)24(29-30)18-10-11-23-17(12-18)9-8-16-4-1-2-7-22(16)23/h1-15H
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