2-(4-ethylphenyl)-5-(hydroxymethyl)-N-(1-oxidanylbutan-2-yl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 2-(4-ethylphenyl)-5-(hydroxymethyl)-N-(1-oxidanylbutan-2-yl)-1,2,3-triazole-4-carboxamide Openeye Name: 2-(4-ethylphenyl)-5-(hydroxymethyl)-N-[1-(hydroxymethyl)propyl]triazole-4-carboxamide CAS Name: 2-(4-ethylphenyl)-N-(1-hydroxybutan-2-yl)-5-(hydroxymethyl)-4-triazolecarboxamide IUPAC Name: 2-(4-ethylphenyl)-N-(1-hydroxybutan-2-yl)-5-(hydroxymethyl)triazole-4-carboxamide Traditional Name: 2-(4-ethylphenyl)-5-methylol-N-(1-methylolpropyl)triazole-4-carboxamide Formula: C16H22N4O3 MolecularWeight: 318.37088

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2N=C(C(=N2)C(=O)NC(CC)CO)CO

Isomeric SMILES

CCC1=CC=C(C=C1)N2N=C(C(=N2)C(=O)NC(CC)CO)CO

InChI

InChI=1S/C16H22N4O3/c1-3-11-5-7-13(8-6-11)20-18-14(10-22)15(19-20)16(23)17-12(4-2)9-21/h5-8,12,21-22H,3-4,9-10H2,1-2H3,(H,17,23)