1-phenoxy-1-(1,2,4-triazol-1-yl)butan-2-one

Systemtic Name: 1-phenoxy-1-(1,2,4-triazol-1-yl)butan-2-one Openeye Name: 1-phenoxy-1-(1,2,4-triazol-1-yl)butan-2-one CAS Name: 1-phenoxy-1-(1,2,4-triazol-1-yl)-2-butanone IUPAC Name: 1-phenoxy-1-(1,2,4-triazol-1-yl)butan-2-one Traditional Name: 1-phenoxy-1-(1,2,4-triazol-1-yl)butan-2-one Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(N1C=NC=N1)OC2=CC=CC=C2

Isomeric SMILES

CCC(=O)C(N1C=NC=N1)OC2=CC=CC=C2

InChI

InChI=1S/C12H13N3O2/c1-2-11(16)12(15-9-13-8-14-15)17-10-6-4-3-5-7-10/h3-9,12H,2H2,1H3