4-(4-chlorophenyl)carbonyl-N'-nitro-piperazine-1-carboximidamide

Systemtic Name: 4-(4-chlorophenyl)carbonyl-N'-nitro-piperazine-1-carboximidamide Openeye Name: 4-(4-chlorobenzoyl)-N'-nitro-piperazine-1-carboxamidine CAS Name: 4-[(4-chlorophenyl)-oxomethyl]-N'-nitro-1-piperazinecarboximidamide IUPAC Name: 4-(4-chlorobenzoyl)-N'-nitropiperazine-1-carboximidamide Traditional Name: 4-(4-chlorobenzoyl)-N'-nitro-piperazine-1-carboxamidine Formula: C12H14ClN5O3 MolecularWeight: 311.72426

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)Cl)C(=N[N+](=O)[O-])N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)Cl)/C(=N\[N+](=O)[O-])/N

InChI

InChI=1S/C12H14ClN5O3/c13-10-3-1-9(2-4-10)11(19)16-5-7-17(8-6-16)12(14)15-18(20)21/h1-4H,5-8H2,(H2,14,15)