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

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-homopiperonyl-4-(1,2,4-triazol-1-yl)benzamide Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNC(=O)C3=CC=C(C=C3)N4C=NC=N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNC(=O)C3=CC=C(C=C3)N4C=NC=N4

InChI

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