N-(1,3-benzodioxol-5-ylmethyl)-1-(4-methylphenyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-methylphenyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(p-tolyl)triazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-methylphenyl)-4-triazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-methylphenyl)triazole-4-carboxamide Traditional Name: N-piperonyl-1-(p-tolyl)triazole-4-carboxamide Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(N=N2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(N=N2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H16N4O3/c1-12-2-5-14(6-3-12)22-10-15(20-21-22)18(23)19-9-13-4-7-16-17(8-13)25-11-24-16/h2-8,10H,9,11H2,1H3,(H,19,23)