4,6-bis(2-chloranylethanoylamino)benzene-1,3-dicarboxylic acid

Systemtic Name: 4,6-bis(2-chloranylethanoylamino)benzene-1,3-dicarboxylic acid Openeye Name: 4,6-bis[(2-chloroacetyl)amino]benzene-1,3-dicarboxylic acid CAS Name: 4,6-bis[(2-chloro-1-oxoethyl)amino]benzene-1,3-dicarboxylic acid IUPAC Name: 4,6-bis[(2-chloroacetyl)amino]benzene-1,3-dicarboxylic acid Traditional Name: 4,6-bis[(2-chloroacetyl)amino]isophthalic acid Formula: C12H10Cl2N2O6 MolecularWeight: 349.1236

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1C(=O)O)NC(=O)CCl)NC(=O)CCl)C(=O)O

Isomeric SMILES

C1=C(C(=CC(=C1C(=O)O)NC(=O)CCl)NC(=O)CCl)C(=O)O

InChI

InChI=1S/C12H10Cl2N2O6/c13-3-9(17)15-7-2-8(16-10(18)4-14)6(12(21)22)1-5(7)11(19)20/h1-2H,3-4H2,(H,15,17)(H,16,18)(H,19,20)(H,21,22)