2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-5-nitro-benzenecarbonitrile Openeye Name: 2-[4-(1H-benzimidazol-2-yl)-1-piperidyl]-5-nitro-benzonitrile CAS Name: 2-[4-(1H-benzimidazol-2-yl)-1-piperidinyl]-5-nitrobenzonitrile IUPAC Name: 2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-5-nitrobenzonitrile Traditional Name: 2-[4-(1H-benzimidazol-2-yl)piperidino]-5-nitro-benzonitrile Formula: C19H17N5O2 MolecularWeight: 347.37058

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3N2)C4=C(C=C(C=C4)[N+](=O)[O-])C#N

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3N2)C4=C(C=C(C=C4)[N+](=O)[O-])C#N

InChI

InChI=1S/C19H17N5O2/c20-12-14-11-15(24(25)26)5-6-18(14)23-9-7-13(8-10-23)19-21-16-3-1-2-4-17(16)22-19/h1-6,11,13H,7-10H2,(H,21,22)