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

Systemtic Name: 1-(3-chlorophenyl)-3-(1,2,4-triazol-1-yl)propan-2-one Openeye Name: 1-(3-chlorophenyl)-3-(1,2,4-triazol-1-yl)propan-2-one CAS Name: 1-(3-chlorophenyl)-3-(1,2,4-triazol-1-yl)-2-propanone IUPAC Name: 1-(3-chlorophenyl)-3-(1,2,4-triazol-1-yl)propan-2-one Traditional Name: 1-(3-chlorophenyl)-3-(1,2,4-triazol-1-yl)acetone Formula: C11H10ClN3O MolecularWeight: 235.6696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CC(=O)CN2C=NC=N2

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CC(=O)CN2C=NC=N2

InChI

InChI=1S/C11H10ClN3O/c12-10-3-1-2-9(4-10)5-11(16)6-15-8-13-7-14-15/h1-4,7-8H,5-6H2