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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(C)(C)CC1=CC=C(C=C1)Cl)N2C=NC=N2

Isomeric SMILES

CC(C(=O)C(C)(C)CC1=CC=C(C=C1)Cl)N2C=NC=N2

InChI

InChI=1S/C15H18ClN3O/c1-11(19-10-17-9-18-19)14(20)15(2,3)8-12-4-6-13(16)7-5-12/h4-7,9-11H,8H2,1-3H3