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

Systemtic Name: 2-(2,4-dichlorophenyl)-2-oxidanyl-1-(1,2,4-triazol-1-yl)hexan-3-one Openeye Name: 2-(2,4-dichlorophenyl)-2-hydroxy-1-(1,2,4-triazol-1-yl)hexan-3-one CAS Name: 2-(2,4-dichlorophenyl)-2-hydroxy-1-(1,2,4-triazol-1-yl)-3-hexanone IUPAC Name: 2-(2,4-dichlorophenyl)-2-hydroxy-1-(1,2,4-triazol-1-yl)hexan-3-one Traditional Name: 2-(2,4-dichlorophenyl)-2-hydroxy-1-(1,2,4-triazol-1-yl)hexan-3-one Formula: C14H15Cl2N3O2 MolecularWeight: 328.1938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15Cl2N3O2/c1-2-3-13(20)14(21,7-19-9-17-8-18-19)11-5-4-10(15)6-12(11)16/h4-6,8-9,21H,2-3,7H2,1H3