benzene-1,3-diamine; benzene-1,3-dicarboxylic acid

Systemtic Name: benzene-1,3-diamine; benzene-1,3-dicarboxylic acid Openeye Name: benzene-1,3-diamine; isophthalic acid CAS Name: benzene-1,3-diamine; benzene-1,3-dicarboxylic acid IUPAC Name: benzene-1,3-diamine; benzene-1,3-dicarboxylic acid Traditional Name: isophthalic acid; m-phenylenediamine Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=CC(=C1)N)N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=CC(=C1)N)N

InChI

InChI=1S/C8H6O4.C6H8N2/c9-7(10)5-2-1-3-6(4-5)8(11)12;7-5-2-1-3-6(8)4-5/h1-4H,(H,9,10)(H,11,12);1-4H,7-8H2