1-[1-(2-chloranylphenoxy)-6-(1,2,4-triazol-1-yl)cyclohexa-2,4-dien-1-yl]propan-1-one

Systemtic Name: 1-[1-(2-chloranylphenoxy)-6-(1,2,4-triazol-1-yl)cyclohexa-2,4-dien-1-yl]propan-1-one Openeye Name: 1-[1-(2-chlorophenoxy)-6-(1,2,4-triazol-1-yl)cyclohexa-2,4-dien-1-yl]propan-1-one CAS Name: 1-[1-(2-chlorophenoxy)-6-(1,2,4-triazol-1-yl)-1-cyclohexa-2,4-dienyl]-1-propanone IUPAC Name: 1-[1-(2-chlorophenoxy)-6-(1,2,4-triazol-1-yl)cyclohexa-2,4-dien-1-yl]propan-1-one Traditional Name: 1-[1-(2-chlorophenoxy)-6-(1,2,4-triazol-1-yl)cyclohexa-2,4-dien-1-yl]propan-1-one Formula: C17H16ClN3O2 MolecularWeight: 329.78084

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1(C=CC=CC1N2C=NC=N2)OC3=CC=CC=C3Cl

Isomeric SMILES

CCC(=O)C1(C=CC=CC1N2C=NC=N2)OC3=CC=CC=C3Cl

InChI

InChI=1S/C17H16ClN3O2/c1-2-16(22)17(23-14-8-4-3-7-13(14)18)10-6-5-9-15(17)21-12-19-11-20-21/h3-12,15H,2H2,1H3