[4-[4-phenyl-3-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridin-1-yl]sulfonyl propanoate

Systemtic Name: [4-[4-phenyl-3-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridin-1-yl]sulfonyl propanoate Openeye Name: [4-[4-phenyl-3-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridin-1-yl]sulfonyl propanoate CAS Name: propanoic acid [4-[4-phenyl-3-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridin-1-yl]sulfonyl ester IUPAC Name: [4-[4-phenyl-3-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridin-1-yl]sulfonyl propanoate Traditional Name: propionic acid [4-[4-phenyl-3-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridin-1-yl]sulfonyl ester Formula: C21H20F3NO4S MolecularWeight: 439.44801

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OS(=O)(=O)N1CCC(=CC1)C2=CC(=C(C=C2)C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CCC(=O)OS(=O)(=O)N1CCC(=CC1)C2=CC(=C(C=C2)C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H20F3NO4S/c1-2-20(26)29-30(27,28)25-12-10-15(11-13-25)17-8-9-18(16-6-4-3-5-7-16)19(14-17)21(22,23)24/h3-10,14H,2,11-13H2,1H3