N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(4-fluorophenyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(4-fluorophenyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(4-fluorophenyl)triazole-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(4-fluorophenyl)-4-triazolecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(4-fluorophenyl)triazole-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(4-fluorophenyl)triazole-4-carboxamide Formula: C18H15FN4O3 MolecularWeight: 354.335103

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNC(=O)C3=CN(N=N3)C4=CC=C(C=C4)F

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)CNC(=O)C3=CN(N=N3)C4=CC=C(C=C4)F

InChI

InChI=1S/C18H15FN4O3/c19-12-5-7-13(8-6-12)23-10-15(21-22-23)18(24)20-9-14-11-25-16-3-1-2-4-17(16)26-14/h1-8,10,14H,9,11H2,(H,20,24)