2-(4-propanoylphenoxy)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-(4-propanoylphenoxy)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-(4-propanoylphenoxy)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-[4-(1-oxopropyl)phenoxy]-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-(4-propanoylphenoxy)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-(4-propionylphenoxy)-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]acetamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C21H22N4O3/c1-2-20(26)18-7-9-19(10-8-18)28-13-21(27)23-11-16-3-5-17(6-4-16)12-25-15-22-14-24-25/h3-10,14-15H,2,11-13H2,1H3,(H,23,27)