N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[2-(4-methyl-1-piperazinyl)-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[2-(4-methylpiperazino)-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C21H22F3N3O3 MolecularWeight: 421.41289

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C21H22F3N3O3/c1-26-8-10-27(11-9-26)16-7-6-14(21(22,23)24)12-15(16)25-20(28)19-13-29-17-4-2-3-5-18(17)30-19/h2-7,12,19H,8-11,13H2,1H3,(H,25,28)