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4-[1,3-benzodioxol-5-ylmethyl(piperidin-4-yl)amino]-6-(trifluoromethyl)chromen-2-one

4-[1,3-benzodioxol-5-ylmethyl(piperidin-4-yl)amino]-6-(trifluoromethyl)chromen-2-one

Systemtic Name:4-[1,3-benzodioxol-5-ylmethyl(piperidin-4-yl)amino]-6-(trifluoromethyl)chromen-2-one
Openeye Name:4-[1,3-benzodioxol-5-ylmethyl(4-piperidyl)amino]-6-(trifluoromethyl)chromen-2-one
CAS Name:4-[1,3-benzodioxol-5-ylmethyl(4-piperidinyl)amino]-6-(trifluoromethyl)-1-benzopyran-2-one
IUPAC Name:4-[1,3-benzodioxol-5-ylmethyl(piperidin-4-yl)amino]-6-(trifluoromethyl)chromen-2-one
Traditional Name:4-[4-piperidyl(piperonyl)amino]-6-(trifluoromethyl)coumarin
Formula: C23H21F3N2O4
MolecularWeight: 446.41905
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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N(CC2=CC3=C(C=C2)OCO3)C4=CC(=O)OC5=C4C=C(C=C5)C(F)(F)F


Isomeric SMILES

C1CNCCC1N(CC2=CC3=C(C=C2)OCO3)C4=CC(=O)OC5=C4C=C(C=C5)C(F)(F)F


InChI

InChI=1S/C23H21F3N2O4/c24-23(25,26)15-2-4-19-17(10-15)18(11-22(29)32-19)28(16-5-7-27-8-6-16)12-14-1-3-20-21(9-14)31-13-30-20/h1-4,9-11,16,27H,5-8,12-13H2


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