2-[4-[2,3-bis(oxidanyl)propyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-[4-[2,3-bis(oxidanyl)propyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Openeye Name: 2-[4-(2,3-dihydroxypropyl)piperazin-1-yl]cyclohepta-2,4,6-trien-1-one CAS Name: 2-[4-(2,3-dihydroxypropyl)-1-piperazinyl]-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-[4-(2,3-dihydroxypropyl)piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Traditional Name: 2-(4-glycerylpiperazino)cyclohepta-2,4,6-trien-1-one Formula: C14H20N2O3 MolecularWeight: 264.3202

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(CO)O)C2=CC=CC=CC2=O

Isomeric SMILES

C1CN(CCN1CC(CO)O)C2=CC=CC=CC2=O

InChI

InChI=1S/C14H20N2O3/c17-11-12(18)10-15-6-8-16(9-7-15)13-4-2-1-3-5-14(13)19/h1-5,12,17-18H,6-11H2