5-cyanobenzene-1,3-dicarboxylic acid

Systemtic Name: 5-cyanobenzene-1,3-dicarboxylic acid Openeye Name: 5-cyanobenzene-1,3-dicarboxylic acid CAS Name: 5-cyanobenzene-1,3-dicarboxylic acid IUPAC Name: 5-cyanobenzene-1,3-dicarboxylic acid Traditional Name: 5-cyanoisophthalic acid Formula: C9H5NO4 MolecularWeight: 191.1403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H5NO4/c10-4-5-1-6(8(11)12)3-7(2-5)9(13)14/h1-3H,(H,11,12)(H,13,14)