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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxyphenyl)-5-(hydroxymethyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxyphenyl)-5-(hydroxymethyl)triazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxyphenyl)-5-(hydroxymethyl)-4-triazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxyphenyl)-5-(hydroxymethyl)triazole-4-carboxamide Traditional Name: 5-methylol-N-piperonyl-2-p-phenetyl-triazole-4-carboxamide Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2N=C(C(=N2)C(=O)NCC3=CC4=C(C=C3)OCO4)CO

Isomeric SMILES

CCOC1=CC=C(C=C1)N2N=C(C(=N2)C(=O)NCC3=CC4=C(C=C3)OCO4)CO

InChI

InChI=1S/C20H20N4O5/c1-2-27-15-6-4-14(5-7-15)24-22-16(11-25)19(23-24)20(26)21-10-13-3-8-17-18(9-13)29-12-28-17/h3-9,25H,2,10-12H2,1H3,(H,21,26)