3-nitro-4-pyrrolidin-1-yl-benzenecarbonitrile

Systemtic Name: 3-nitro-4-pyrrolidin-1-yl-benzenecarbonitrile Openeye Name: 3-nitro-4-pyrrolidin-1-yl-benzonitrile CAS Name: 3-nitro-4-(1-pyrrolidinyl)benzonitrile IUPAC Name: 3-nitro-4-pyrrolidin-1-ylbenzonitrile Traditional Name: 3-nitro-4-pyrrolidino-benzonitrile Formula: C11H11N3O2 MolecularWeight: 217.22394

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C11H11N3O2/c12-8-9-3-4-10(11(7-9)14(15)16)13-5-1-2-6-13/h3-4,7H,1-2,5-6H2