3-(methylamino)-4-nitro-benzenecarbonitrile

Systemtic Name: 3-(methylamino)-4-nitro-benzenecarbonitrile Openeye Name: 3-(methylamino)-4-nitro-benzonitrile CAS Name: 3-(methylamino)-4-nitrobenzonitrile IUPAC Name: 3-(methylamino)-4-nitrobenzonitrile Traditional Name: 3-(methylamino)-4-nitro-benzonitrile Formula: C8H7N3O2 MolecularWeight: 177.16008

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=CC(=C1)C#N)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=CC(=C1)C#N)[N+](=O)[O-]

InChI

InChI=1S/C8H7N3O2/c1-10-7-4-6(5-9)2-3-8(7)11(12)13/h2-4,10H,1H3