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

Systemtic Name: 3-nitro-4-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]benzenecarbonitrile Openeye Name: 3-nitro-4-[4-(2-oxopyrrolidin-1-yl)anilino]benzonitrile CAS Name: 3-nitro-4-[4-(2-oxo-1-pyrrolidinyl)anilino]benzonitrile IUPAC Name: 3-nitro-4-[4-(2-oxopyrrolidin-1-yl)anilino]benzonitrile Traditional Name: 4-[4-(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=C(C=C2)NC3=C(C=C(C=C3)C#N)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H14N4O3/c18-11-12-3-8-15(16(10-12)21(23)24)19-13-4-6-14(7-5-13)20-9-1-2-17(20)22/h3-8,10,19H,1-2,9H2