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

Systemtic Name: N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]-piperonylamide Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C18H16N4O3/c23-18(15-5-6-16-17(7-15)25-12-24-16)20-8-13-1-3-14(4-2-13)9-22-11-19-10-21-22/h1-7,10-11H,8-9,12H2,(H,20,23)