1-[4-(2-chlorophenyl)piperazin-1-yl]-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol

Systemtic Name: 1-[4-(2-chlorophenyl)piperazin-1-yl]-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol Openeye Name: 1-[4-(2-chlorophenyl)piperazin-1-yl]-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol CAS Name: 1-[4-(2-chlorophenyl)-1-piperazinyl]-2-(1,2,4-triazol-1-ylmethyl)-2-butanol IUPAC Name: 1-[4-(2-chlorophenyl)piperazin-1-yl]-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol Traditional Name: 1-[4-(2-chlorophenyl)piperazino]-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol Formula: C17H24ClN5O MolecularWeight: 349.85836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1CCN(CC1)C2=CC=CC=C2Cl)(CN3C=NC=N3)O

Isomeric SMILES

CCC(CN1CCN(CC1)C2=CC=CC=C2Cl)(CN3C=NC=N3)O

InChI

InChI=1S/C17H24ClN5O/c1-2-17(24,12-23-14-19-13-20-23)11-21-7-9-22(10-8-21)16-6-4-3-5-15(16)18/h3-6,13-14,24H,2,7-12H2,1H3