2-(2,4-dichlorophenyl)-2-oxidanyl-1-(1,2,4-triazol-1-yl)pentan-3-one

Systemtic Name: 2-(2,4-dichlorophenyl)-2-oxidanyl-1-(1,2,4-triazol-1-yl)pentan-3-one Openeye Name: 2-(2,4-dichlorophenyl)-2-hydroxy-1-(1,2,4-triazol-1-yl)pentan-3-one CAS Name: 2-(2,4-dichlorophenyl)-2-hydroxy-1-(1,2,4-triazol-1-yl)-3-pentanone IUPAC Name: 2-(2,4-dichlorophenyl)-2-hydroxy-1-(1,2,4-triazol-1-yl)pentan-3-one Traditional Name: 2-(2,4-dichlorophenyl)-2-hydroxy-1-(1,2,4-triazol-1-yl)pentan-3-one Formula: C13H13Cl2N3O2 MolecularWeight: 314.16722

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CN1C=NC=N1)(C2=C(C=C(C=C2)Cl)Cl)O

Isomeric SMILES

CCC(=O)C(CN1C=NC=N1)(C2=C(C=C(C=C2)Cl)Cl)O

InChI

InChI=1S/C13H13Cl2N3O2/c1-2-12(19)13(20,6-18-8-16-7-17-18)10-4-3-9(14)5-11(10)15/h3-5,7-8,20H,2,6H2,1H3