N-[1-[(4-chlorophenyl)methyl]-1,2,4-triazol-3-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]-1,2,4-triazol-3-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]-1,2,4-triazol-3-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-1,2,4-triazol-3-yl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]-1,2,4-triazol-3-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[1-(4-chlorobenzyl)-1,2,4-triazol-3-yl]-piperonylamide Formula: C17H13ClN4O3 MolecularWeight: 356.76312

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=NN(C=N3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=NN(C=N3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C17H13ClN4O3/c18-13-4-1-11(2-5-13)8-22-9-19-17(21-22)20-16(23)12-3-6-14-15(7-12)25-10-24-14/h1-7,9H,8,10H2,(H,20,21,23)