4,4,4-tris(chloranyl)-1-cyclopropyl-3-oxidanyl-2-(1,2,4-triazol-1-yl)butan-1-one

Systemtic Name: 4,4,4-tris(chloranyl)-1-cyclopropyl-3-oxidanyl-2-(1,2,4-triazol-1-yl)butan-1-one Openeye Name: 4,4,4-trichloro-1-cyclopropyl-3-hydroxy-2-(1,2,4-triazol-1-yl)butan-1-one CAS Name: 4,4,4-trichloro-1-cyclopropyl-3-hydroxy-2-(1,2,4-triazol-1-yl)-1-butanone IUPAC Name: 4,4,4-trichloro-1-cyclopropyl-3-hydroxy-2-(1,2,4-triazol-1-yl)butan-1-one Traditional Name: 4,4,4-trichloro-1-cyclopropyl-3-hydroxy-2-(1,2,4-triazol-1-yl)butan-1-one Formula: C9H10Cl3N3O2 MolecularWeight: 298.5536

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)C(C(C(Cl)(Cl)Cl)O)N2C=NC=N2

Isomeric SMILES

C1CC1C(=O)C(C(C(Cl)(Cl)Cl)O)N2C=NC=N2

InChI

InChI=1S/C9H10Cl3N3O2/c10-9(11,12)8(17)6(7(16)5-1-2-5)15-4-13-3-14-15/h3-6,8,17H,1-2H2