4-[(2-chloranyl-5-nitro-phenyl)methyl]piperazin-2-one

Systemtic Name: 4-[(2-chloranyl-5-nitro-phenyl)methyl]piperazin-2-one Openeye Name: 4-[(2-chloro-5-nitro-phenyl)methyl]piperazin-2-one CAS Name: 4-[(2-chloro-5-nitrophenyl)methyl]-2-piperazinone IUPAC Name: 4-[(2-chloro-5-nitrophenyl)methyl]piperazin-2-one Traditional Name: 4-(2-chloro-5-nitro-benzyl)piperazin-2-one Formula: C11H12ClN3O3 MolecularWeight: 269.68428

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)CC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(CC(=O)N1)CC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H12ClN3O3/c12-10-2-1-9(15(17)18)5-8(10)6-14-4-3-13-11(16)7-14/h1-2,5H,3-4,6-7H2,(H,13,16)