5-chloranyl-2-[4-(2-hydroxyethyl)piperazin-1-yl]cyclohepta-2,4,6-trien-1-one

Systemtic Name: 5-chloranyl-2-[4-(2-hydroxyethyl)piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Openeye Name: 5-chloro-2-[4-(2-hydroxyethyl)piperazin-1-yl]cyclohepta-2,4,6-trien-1-one CAS Name: 5-chloro-2-[4-(2-hydroxyethyl)-1-piperazinyl]-1-cyclohepta-2,4,6-trienone IUPAC Name: 5-chloro-2-[4-(2-hydroxyethyl)piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Traditional Name: 5-chloro-2-[4-(2-hydroxyethyl)piperazino]cyclohepta-2,4,6-trien-1-one Formula: C13H17ClN2O2 MolecularWeight: 268.73928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=CC=C(C=CC2=O)Cl

Isomeric SMILES

C1CN(CCN1CCO)C2=CC=C(C=CC2=O)Cl

InChI

InChI=1S/C13H17ClN2O2/c14-11-1-3-12(13(18)4-2-11)16-7-5-15(6-8-16)9-10-17/h1-4,17H,5-10H2