1-(4-chlorophenyl)-2,2-dimethyl-3-(1,2,4-triazol-1-yl)pentan-1-one

Systemtic Name: 1-(4-chlorophenyl)-2,2-dimethyl-3-(1,2,4-triazol-1-yl)pentan-1-one Openeye Name: 1-(4-chlorophenyl)-2,2-dimethyl-3-(1,2,4-triazol-1-yl)pentan-1-one CAS Name: 1-(4-chlorophenyl)-2,2-dimethyl-3-(1,2,4-triazol-1-yl)-1-pentanone IUPAC Name: 1-(4-chlorophenyl)-2,2-dimethyl-3-(1,2,4-triazol-1-yl)pentan-1-one Traditional Name: 1-(4-chlorophenyl)-2,2-dimethyl-3-(1,2,4-triazol-1-yl)pentan-1-one Formula: C15H18ClN3O MolecularWeight: 291.77592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18ClN3O/c1-4-13(19-10-17-9-18-19)15(2,3)14(20)11-5-7-12(16)8-6-11/h5-10,13H,4H2,1-3H3