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

Systemtic Name: N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-piperonylamide Formula: C17H14N4O3 MolecularWeight: 322.31806

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C17H14N4O3/c22-17(13-3-6-15-16(7-13)24-11-23-15)20-14-4-1-12(2-5-14)8-21-10-18-9-19-21/h1-7,9-10H,8,11H2,(H,20,22)