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

Systemtic Name: 1-[3-(2-methoxyethoxy)-5-(2-methylphenyl)-1,2,4-triazol-1-yl]decan-1-one Openeye Name: 1-[3-(2-methoxyethoxy)-5-(o-tolyl)-1,2,4-triazol-1-yl]decan-1-one CAS Name: 1-[3-(2-methoxyethoxy)-5-(2-methylphenyl)-1,2,4-triazol-1-yl]-1-decanone IUPAC Name: 1-[3-(2-methoxyethoxy)-5-(2-methylphenyl)-1,2,4-triazol-1-yl]decan-1-one Traditional Name: 1-[3-(2-methoxyethoxy)-5-(o-tolyl)-1,2,4-triazol-1-yl]decan-1-one Formula: C22H33N3O3 MolecularWeight: 387.51572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H33N3O3/c1-4-5-6-7-8-9-10-15-20(26)25-21(19-14-12-11-13-18(19)2)23-22(24-25)28-17-16-27-3/h11-14H,4-10,15-17H2,1-3H3