1-(4-bromanyl-3-nitro-phenyl)carbonylpiperidine-3-carboxamide

Systemtic Name: 1-(4-bromanyl-3-nitro-phenyl)carbonylpiperidine-3-carboxamide Openeye Name: 1-(4-bromo-3-nitro-benzoyl)piperidine-3-carboxamide CAS Name: 1-[(4-bromo-3-nitrophenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-bromo-3-nitrobenzoyl)piperidine-3-carboxamide Traditional Name: 1-(4-bromo-3-nitro-benzoyl)nipecotamide Formula: C13H14BrN3O4 MolecularWeight: 356.17196

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C13H14BrN3O4/c14-10-4-3-8(6-11(10)17(20)21)13(19)16-5-1-2-9(7-16)12(15)18/h3-4,6,9H,1-2,5,7H2,(H2,15,18)