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methyl 5,5,5-tris(fluoranyl)-4-[(3-methylphenyl)amino]pentanoate

methyl 5,5,5-tris(fluoranyl)-4-[(3-methylphenyl)amino]pentanoate

Systemtic Name:methyl 5,5,5-tris(fluoranyl)-4-[(3-methylphenyl)amino]pentanoate
Openeye Name:methyl 5,5,5-trifluoro-4-(3-methylanilino)pentanoate
CAS Name:5,5,5-trifluoro-4-(3-methylanilino)pentanoic acid methyl ester
IUPAC Name:methyl 5,5,5-trifluoro-4-(3-methylanilino)pentanoate
Traditional Name:5,5,5-trifluoro-4-(m-toluidino)valeric acid methyl ester
Formula: C13H16F3NO2
MolecularWeight: 275.26685
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(CCC(=O)OC)C(F)(F)F


Isomeric SMILES

CC1=CC(=CC=C1)NC(CCC(=O)OC)C(F)(F)F


InChI

InChI=1S/C13H16F3NO2/c1-9-4-3-5-10(8-9)17-11(13(14,15)16)6-7-12(18)19-2/h3-5,8,11,17H,6-7H2,1-2H3


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