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

Systemtic Name: 4-chloranyl-1-[3-(2-methoxyethoxy)-5-(4-methylphenyl)-1,2,4-triazol-1-yl]butan-1-one Openeye Name: 4-chloro-1-[3-(2-methoxyethoxy)-5-(p-tolyl)-1,2,4-triazol-1-yl]butan-1-one CAS Name: 4-chloro-1-[3-(2-methoxyethoxy)-5-(4-methylphenyl)-1,2,4-triazol-1-yl]-1-butanone IUPAC Name: 4-chloro-1-[3-(2-methoxyethoxy)-5-(4-methylphenyl)-1,2,4-triazol-1-yl]butan-1-one Traditional Name: 4-chloro-1-[3-(2-methoxyethoxy)-5-(p-tolyl)-1,2,4-triazol-1-yl]butan-1-one Formula: C16H20ClN3O3 MolecularWeight: 337.8013

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2C(=O)CCCCl)OCCOC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2C(=O)CCCCl)OCCOC

InChI

InChI=1S/C16H20ClN3O3/c1-12-5-7-13(8-6-12)15-18-16(23-11-10-22-2)19-20(15)14(21)4-3-9-17/h5-8H,3-4,9-11H2,1-2H3