N-(3-oxidanylidene-1H-2-benzofuran-5-yl)-1-phenyl-5-propyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(3-oxidanylidene-1H-2-benzofuran-5-yl)-1-phenyl-5-propyl-1,2,3-triazole-4-carboxamide Openeye Name: N-(3-oxo-1H-isobenzofuran-5-yl)-1-phenyl-5-propyl-triazole-4-carboxamide CAS Name: N-(3-oxo-1H-isobenzofuran-5-yl)-1-phenyl-5-propyl-4-triazolecarboxamide IUPAC Name: N-(3-oxo-1H-2-benzofuran-5-yl)-1-phenyl-5-propyltriazole-4-carboxamide Traditional Name: N-(3-ketophthalan-5-yl)-1-phenyl-5-propyl-triazole-4-carboxamide Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=NN1C2=CC=CC=C2)C(=O)NC3=CC4=C(COC4=O)C=C3

Isomeric SMILES

CCCC1=C(N=NN1C2=CC=CC=C2)C(=O)NC3=CC4=C(COC4=O)C=C3

InChI

InChI=1S/C20H18N4O3/c1-2-6-17-18(22-23-24(17)15-7-4-3-5-8-15)19(25)21-14-10-9-13-12-27-20(26)16(13)11-14/h3-5,7-11H,2,6,12H2,1H3,(H,21,25)