5-[(3-cyanophenyl)amino]-2-nitro-benzoate

Systemtic Name: 5-[(3-cyanophenyl)amino]-2-nitro-benzoate Openeye Name: 5-(3-cyanoanilino)-2-nitro-benzoate CAS Name: 5-(3-cyanoanilino)-2-nitrobenzoate IUPAC Name: 5-(3-cyanoanilino)-2-nitrobenzoate Traditional Name: 5-(3-cyanoanilino)-2-nitro-benzoate Formula: C14H8N3O4- MolecularWeight: 282.23102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)[O-])C#N

InChI

InChI=1S/C14H9N3O4/c15-8-9-2-1-3-10(6-9)16-11-4-5-13(17(20)21)12(7-11)14(18)19/h1-7,16H,(H,18,19)/p-1