N-(1,3-benzodioxol-5-yl)-1-phenyl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-phenyl-1,2,4-triazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-phenyl-1,2,4-triazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-phenyl-1,2,4-triazole-3-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-phenyl-1,2,4-triazole-3-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-phenyl-1,2,4-triazole-3-carboxamide Formula: C16H12N4O3 MolecularWeight: 308.29148

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=NN(C=N3)C4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=NN(C=N3)C4=CC=CC=C4

InChI

InChI=1S/C16H12N4O3/c21-16(18-11-6-7-13-14(8-11)23-10-22-13)15-17-9-20(19-15)12-4-2-1-3-5-12/h1-9H,10H2,(H,18,21)