3-butoxy-5-(2-methylphenyl)-1H-1,2,4-triazole

Systemtic Name: 3-butoxy-5-(2-methylphenyl)-1H-1,2,4-triazole Openeye Name: 3-butoxy-5-(o-tolyl)-1H-1,2,4-triazole CAS Name: 3-butoxy-5-(2-methylphenyl)-1H-1,2,4-triazole IUPAC Name: 3-butoxy-5-(2-methylphenyl)-1H-1,2,4-triazole Traditional Name: 3-butoxy-5-(o-tolyl)-1H-1,2,4-triazole Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NNC(=N1)C2=CC=CC=C2C

Isomeric SMILES

CCCCOC1=NNC(=N1)C2=CC=CC=C2C

InChI

InChI=1S/C13H17N3O/c1-3-4-9-17-13-14-12(15-16-13)11-8-6-5-7-10(11)2/h5-8H,3-4,9H2,1-2H3,(H,14,15,16)