3-(5-bromanyl-2-nitro-phenyl)-1-methyl-piperidin-2-one

Systemtic Name: 3-(5-bromanyl-2-nitro-phenyl)-1-methyl-piperidin-2-one Openeye Name: 3-(5-bromo-2-nitro-phenyl)-1-methyl-piperidin-2-one CAS Name: 3-(5-bromo-2-nitrophenyl)-1-methyl-2-piperidinone IUPAC Name: 3-(5-bromo-2-nitrophenyl)-1-methylpiperidin-2-one Traditional Name: 3-(5-bromo-2-nitro-phenyl)-1-methyl-2-piperidone Formula: C12H13BrN2O3 MolecularWeight: 313.14722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1=O)C2=C(C=CC(=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CN1CCCC(C1=O)C2=C(C=CC(=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H13BrN2O3/c1-14-6-2-3-9(12(14)16)10-7-8(13)4-5-11(10)15(17)18/h4-5,7,9H,2-3,6H2,1H3