N-(4-chloranyl-3-nitro-phenyl)-4-ethanoyl-piperazine-1-carboxamide

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-4-ethanoyl-piperazine-1-carboxamide Openeye Name: 4-acetyl-N-(4-chloro-3-nitro-phenyl)piperazine-1-carboxamide CAS Name: 4-acetyl-N-(4-chloro-3-nitrophenyl)-1-piperazinecarboxamide IUPAC Name: 4-acetyl-N-(4-chloro-3-nitrophenyl)piperazine-1-carboxamide Traditional Name: 4-acetyl-N-(4-chloro-3-nitro-phenyl)piperazine-1-carboxamide Formula: C13H15ClN4O4 MolecularWeight: 326.7356

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H15ClN4O4/c1-9(19)16-4-6-17(7-5-16)13(20)15-10-2-3-11(14)12(8-10)18(21)22/h2-3,8H,4-7H2,1H3,(H,15,20)