2-bromanyl-7-(piperidin-1-ylmethylamino)cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-bromanyl-7-(piperidin-1-ylmethylamino)cyclohepta-2,4,6-trien-1-one Openeye Name: 2-bromo-7-(1-piperidylmethylamino)cyclohepta-2,4,6-trien-1-one CAS Name: 2-bromo-7-(1-piperidinylmethylamino)-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-bromo-7-(piperidin-1-ylmethylamino)cyclohepta-2,4,6-trien-1-one Traditional Name: 2-bromo-7-(piperidinomethylamino)cyclohepta-2,4,6-trien-1-one Formula: C13H17BrN2O MolecularWeight: 297.19088

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CNC2=CC=CC=C(C2=O)Br

Isomeric SMILES

C1CCN(CC1)CNC2=CC=CC=C(C2=O)Br

InChI

InChI=1S/C13H17BrN2O/c14-11-6-2-3-7-12(13(11)17)15-10-16-8-4-1-5-9-16/h2-3,6-7H,1,4-5,8-10H2,(H,15,17)