benzene-1,3-diamine; benzene-1,3-dicarbonyl chloride; benzene-1,4-dicarbonyl chloride

Systemtic Name: benzene-1,3-diamine; benzene-1,3-dicarbonyl chloride; benzene-1,4-dicarbonyl chloride Openeye Name: benzene-1,3-diamine; benzene-1,3-dicarbonyl chloride; benzene-1,4-dicarbonyl chloride CAS Name: benzene-1,3-diamine; benzene-1,3-dicarbonyl chloride; benzene-1,4-dicarbonyl chloride IUPAC Name: benzene-1,3-diamine; benzene-1,3-dicarbonyl chloride; benzene-1,4-dicarbonyl chloride Traditional Name: benzene-1,3-dicarbonyl chloride; benzene-1,4-dicarbonyl chloride; m-phenylenediamine Formula: C22H16Cl4N2O4 MolecularWeight: 514.18544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C8H4Cl2O2.C6H8N2/c9-7(11)5-1-2-6(4-3-5)8(10)12;9-7(11)5-2-1-3-6(4-5)8(10)12;7-5-2-1-3-6(8)4-5/h2*1-4H;1-4H,7-8H2