1-[3-(2-methoxyethoxy)-5-(2-methylphenyl)-1,2,4-triazol-1-yl]pentan-1-one

Systemtic Name: 1-[3-(2-methoxyethoxy)-5-(2-methylphenyl)-1,2,4-triazol-1-yl]pentan-1-one Openeye Name: 1-[3-(2-methoxyethoxy)-5-(o-tolyl)-1,2,4-triazol-1-yl]pentan-1-one CAS Name: 1-[3-(2-methoxyethoxy)-5-(2-methylphenyl)-1,2,4-triazol-1-yl]-1-pentanone IUPAC Name: 1-[3-(2-methoxyethoxy)-5-(2-methylphenyl)-1,2,4-triazol-1-yl]pentan-1-one Traditional Name: 1-[3-(2-methoxyethoxy)-5-(o-tolyl)-1,2,4-triazol-1-yl]pentan-1-one Formula: C17H23N3O3 MolecularWeight: 317.38282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1C(=NC(=N1)OCCOC)C2=CC=CC=C2C

Isomeric SMILES

CCCCC(=O)N1C(=NC(=N1)OCCOC)C2=CC=CC=C2C

InChI

InChI=1S/C17H23N3O3/c1-4-5-10-15(21)20-16(14-9-7-6-8-13(14)2)18-17(19-20)23-12-11-22-3/h6-9H,4-5,10-12H2,1-3H3