(2R)-1-phenyl-2-(1,2,4-triazol-1-yl)pentan-1-one

Systemtic Name: (2R)-1-phenyl-2-(1,2,4-triazol-1-yl)pentan-1-one Openeye Name: (2R)-1-phenyl-2-(1,2,4-triazol-1-yl)pentan-1-one CAS Name: (2R)-1-phenyl-2-(1,2,4-triazol-1-yl)-1-pentanone IUPAC Name: (2R)-1-phenyl-2-(1,2,4-triazol-1-yl)pentan-1-one Traditional Name: (2R)-1-phenyl-2-(1,2,4-triazol-1-yl)pentan-1-one Formula: C13H15N3O MolecularWeight: 229.2777

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC[C@H](C(=O)C1=CC=CC=C1)N2C=NC=N2

InChI

InChI=1S/C13H15N3O/c1-2-6-12(16-10-14-9-15-16)13(17)11-7-4-3-5-8-11/h3-5,7-10,12H,2,6H2,1H3/t12-/m1/s1