5-bromanyl-1-[(2R)-1-oxidanylidene-1-piperazin-4-ium-1-yl-pentan-2-yl]pyridin-2-one

Systemtic Name: 5-bromanyl-1-[(2R)-1-oxidanylidene-1-piperazin-4-ium-1-yl-pentan-2-yl]pyridin-2-one Openeye Name: 5-bromo-1-[(1R)-1-(piperazin-4-ium-1-carbonyl)butyl]pyridin-2-one CAS Name: 5-bromo-1-[(2R)-1-oxo-1-(1-piperazin-4-iumyl)pentan-2-yl]-2-pyridinone IUPAC Name: 5-bromo-1-[(2R)-1-oxo-1-piperazin-4-ium-1-ylpentan-2-yl]pyridin-2-one Traditional Name: 5-bromo-1-[(1R)-1-(piperazin-4-ium-1-carbonyl)butyl]-2-pyridone Formula: C14H21BrN3O2+ MolecularWeight: 343.23944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)N1CC[NH2+]CC1)N2C=C(C=CC2=O)Br

Isomeric SMILES

CCC[C@H](C(=O)N1CC[NH2+]CC1)N2C=C(C=CC2=O)Br

InChI

InChI=1S/C14H20BrN3O2/c1-2-3-12(14(20)17-8-6-16-7-9-17)18-10-11(15)4-5-13(18)19/h4-5,10,12,16H,2-3,6-9H2,1H3/p+1/t12-/m1/s1