N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Traditional Name: N-homopiperonyl-4-(1,2,4-triazol-1-ylmethyl)benzamide Formula: C19H18N4O3 MolecularWeight: 350.37122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N4O3/c24-19(16-4-1-15(2-5-16)10-23-12-20-11-22-23)21-8-7-14-3-6-17-18(9-14)26-13-25-17/h1-6,9,11-12H,7-8,10,13H2,(H,21,24)