3-chloranyl-4-cyano-benzoic acid

Systemtic Name: 3-chloranyl-4-cyano-benzoic acid Openeye Name: 3-chloro-4-cyano-benzoic acid CAS Name: 3-chloro-4-cyanobenzoic acid IUPAC Name: 3-chloro-4-cyanobenzoic acid Traditional Name: 3-chloro-4-cyano-benzoic acid Formula: C8H4ClNO2 MolecularWeight: 181.57586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)Cl)C#N

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)Cl)C#N

InChI

InChI=1S/C8H4ClNO2/c9-7-3-5(8(11)12)1-2-6(7)4-10/h1-3H,(H,11,12)