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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=CC(=O)C(=C2)CC(CO)O

Isomeric SMILES

C1CN(CCN1)C2=CC=CC(=O)C(=C2)CC(CO)O

InChI

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