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

Systemtic Name: 2-[4-(3-oxidanylbutan-2-yl)piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Openeye Name: 2-[4-(2-hydroxy-1-methyl-propyl)piperazin-1-yl]cyclohepta-2,4,6-trien-1-one CAS Name: 2-[4-(3-hydroxybutan-2-yl)-1-piperazinyl]-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-[4-(3-hydroxybutan-2-yl)piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Traditional Name: 2-[4-(2-hydroxy-1-methyl-propyl)piperazino]cyclohepta-2,4,6-trien-1-one Formula: C15H22N2O2 MolecularWeight: 262.34738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)O)N1CCN(CC1)C2=CC=CC=CC2=O

Isomeric SMILES

CC(C(C)O)N1CCN(CC1)C2=CC=CC=CC2=O

InChI

InChI=1S/C15H22N2O2/c1-12(13(2)18)16-8-10-17(11-9-16)14-6-4-3-5-7-15(14)19/h3-7,12-13,18H,8-11H2,1-2H3