2-(4-cyclopentylcarbonylpiperazin-1-yl)-5-nitro-benzenecarbonitrile

Systemtic Name: 2-(4-cyclopentylcarbonylpiperazin-1-yl)-5-nitro-benzenecarbonitrile Openeye Name: 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-5-nitro-benzonitrile CAS Name: 2-[4-[cyclopentyl(oxo)methyl]-1-piperazinyl]-5-nitrobenzonitrile IUPAC Name: 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-5-nitrobenzonitrile Traditional Name: 2-[4-(cyclopentanecarbonyl)piperazino]-5-nitro-benzonitrile Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1CCC(C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C17H20N4O3/c18-12-14-11-15(21(23)24)5-6-16(14)19-7-9-20(10-8-19)17(22)13-3-1-2-4-13/h5-6,11,13H,1-4,7-10H2