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4-[cyclopropylmethyl-[3-(4-methoxyphenoxy)propyl]amino]-2-(trifluoromethyl)benzenecarbonitrile
4-[cyclopropylmethyl-[3-(4-methoxyphenoxy)propyl]amino]-2-(trifluoromethyl)benzenecarbonitrile
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Descriptors Computed from Structure
Canonical SMILES:
COC1=CC=C(C=C1)OCCCN(CC2CC2)C3=CC(=C(C=C3)C#N)C(F)(F)F
Isomeric SMILES
COC1=CC=C(C=C1)OCCCN(CC2CC2)C3=CC(=C(C=C3)C#N)C(F)(F)F
InChI
InChI=1S/C22H23F3N2O2/c1-28-19-7-9-20(10-8-19)29-12-2-11-27(15-16-3-4-16)18-6-5-17(14-26)21(13-18)22(23,24)25/h5-10,13,16H,2-4,11-12,15H2,1H3
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