2-[(3-chloranyl-2-cyano-6-nitro-phenyl)amino]ethanoic acid

Systemtic Name: 2-[(3-chloranyl-2-cyano-6-nitro-phenyl)amino]ethanoic acid Openeye Name: 2-(3-chloro-2-cyano-6-nitro-anilino)acetic acid CAS Name: 2-(3-chloro-2-cyano-6-nitroanilino)acetic acid IUPAC Name: 2-(3-chloro-2-cyano-6-nitroanilino)acetic acid Traditional Name: 2-(3-chloro-2-cyano-6-nitro-anilino)acetic acid Formula: C9H6ClN3O4 MolecularWeight: 255.61464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6ClN3O4/c10-6-1-2-7(13(16)17)9(5(6)3-11)12-4-8(14)15/h1-2,12H,4H2,(H,14,15)