5-nitro-2-(4-pyrrolidin-1-ylcarbonylpiperazin-1-yl)benzenecarbonitrile

Systemtic Name: 5-nitro-2-(4-pyrrolidin-1-ylcarbonylpiperazin-1-yl)benzenecarbonitrile Openeye Name: 5-nitro-2-[4-(pyrrolidine-1-carbonyl)piperazin-1-yl]benzonitrile CAS Name: 5-nitro-2-[4-[oxo(1-pyrrolidinyl)methyl]-1-piperazinyl]benzonitrile IUPAC Name: 5-nitro-2-[4-(pyrrolidine-1-carbonyl)piperazin-1-yl]benzonitrile Traditional Name: 5-nitro-2-[4-(pyrrolidine-1-carbonyl)piperazino]benzonitrile Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1CCN(C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C16H19N5O3/c17-12-13-11-14(21(23)24)3-4-15(13)18-7-9-20(10-8-18)16(22)19-5-1-2-6-19/h3-4,11H,1-2,5-10H2