3-nitro-4-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]benzenecarbonitrile

Systemtic Name: 3-nitro-4-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]benzenecarbonitrile Openeye Name: 3-nitro-4-[3-(2-oxopyrrolidin-1-yl)anilino]benzonitrile CAS Name: 3-nitro-4-[3-(2-oxo-1-pyrrolidinyl)anilino]benzonitrile IUPAC Name: 3-nitro-4-[3-(2-oxopyrrolidin-1-yl)anilino]benzonitrile Traditional Name: 4-[3-(2-ketopyrrolidino)anilino]-3-nitro-benzonitrile Formula: C17H14N4O3 MolecularWeight: 322.31806

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC(=CC=C2)NC3=C(C=C(C=C3)C#N)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1)C2=CC(=CC=C2)NC3=C(C=C(C=C3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O3/c18-11-12-6-7-15(16(9-12)21(23)24)19-13-3-1-4-14(10-13)20-8-2-5-17(20)22/h1,3-4,6-7,9-10,19H,2,5,8H2