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methyl (3S)-3-[4-(trifluoromethyl)phenyl]pentanoate

methyl (3S)-3-[4-(trifluoromethyl)phenyl]pentanoate

Systemtic Name:methyl (3S)-3-[4-(trifluoromethyl)phenyl]pentanoate
Openeye Name:methyl (3S)-3-[4-(trifluoromethyl)phenyl]pentanoate
CAS Name:(3S)-3-[4-(trifluoromethyl)phenyl]pentanoic acid methyl ester
IUPAC Name:methyl (3S)-3-[4-(trifluoromethyl)phenyl]pentanoate
Traditional Name:(3S)-3-[4-(trifluoromethyl)phenyl]valeric acid methyl ester
Formula: C13H15F3O2
MolecularWeight: 260.25221
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

CC[C@@H](CC(=O)OC)C1=CC=C(C=C1)C(F)(F)F


InChI

InChI=1S/C13H15F3O2/c1-3-9(8-12(17)18-2)10-4-6-11(7-5-10)13(14,15)16/h4-7,9H,3,8H2,1-2H3/t9-/m0/s1


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