N-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2)NC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2)NC(=O)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C18H16N4O3/c1-11-6-8-12(9-7-11)16-19-18(22-21-16)20-17(23)15-10-24-13-4-2-3-5-14(13)25-15/h2-9,15H,10H2,1H3,(H2,19,20,21,22,23)