4-(4-methanoylpiperazin-1-yl)-3-nitro-benzenecarbonitrile

Systemtic Name: 4-(4-methanoylpiperazin-1-yl)-3-nitro-benzenecarbonitrile Openeye Name: 4-(4-formylpiperazin-1-yl)-3-nitro-benzonitrile CAS Name: 4-(4-formyl-1-piperazinyl)-3-nitrobenzonitrile IUPAC Name: 4-(4-formylpiperazin-1-yl)-3-nitrobenzonitrile Traditional Name: 4-(4-formylpiperazino)-3-nitro-benzonitrile Formula: C12H12N4O3 MolecularWeight: 260.24868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N4O3/c13-8-10-1-2-11(12(7-10)16(18)19)15-5-3-14(9-17)4-6-15/h1-2,7,9H,3-6H2