2-[4-(2-oxidanyl-2-phenyl-ethyl)piperazin-1-yl]cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-[4-(2-oxidanyl-2-phenyl-ethyl)piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Openeye Name: 2-[4-(2-hydroxy-2-phenyl-ethyl)piperazin-1-yl]cyclohepta-2,4,6-trien-1-one CAS Name: 2-[4-(2-hydroxy-2-phenylethyl)-1-piperazinyl]-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-[4-(2-hydroxy-2-phenylethyl)piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Traditional Name: 2-[4-(2-hydroxy-2-phenyl-ethyl)piperazino]cyclohepta-2,4,6-trien-1-one Formula: C19H22N2O2 MolecularWeight: 310.39018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(C2=CC=CC=C2)O)C3=CC=CC=CC3=O

Isomeric SMILES

C1CN(CCN1CC(C2=CC=CC=C2)O)C3=CC=CC=CC3=O

InChI

InChI=1S/C19H22N2O2/c22-18-10-6-2-5-9-17(18)21-13-11-20(12-14-21)15-19(23)16-7-3-1-4-8-16/h1-10,19,23H,11-15H2