1-(2,4-dichlorophenyl)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one

Systemtic Name: 1-(2,4-dichlorophenyl)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one Openeye Name: 1-(2,4-dichlorophenyl)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one CAS Name: 1-(2,4-dichlorophenyl)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)-2-butanone IUPAC Name: 1-(2,4-dichlorophenyl)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one Traditional Name: 1-(2,4-dichlorophenyl)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one Formula: C14H15Cl2N3O MolecularWeight: 312.1944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(C1=C(C=C(C=C1)Cl)Cl)N2C=NC=N2

Isomeric SMILES

CC(C)(C)C(=O)C(C1=C(C=C(C=C1)Cl)Cl)N2C=NC=N2

InChI

InChI=1S/C14H15Cl2N3O/c1-14(2,3)13(20)12(19-8-17-7-18-19)10-5-4-9(15)6-11(10)16/h4-8,12H,1-3H3