2-[[2-carboxy-4-(2-iodanylethanoylamino)phenyl]diazenyl]-5-(2-iodanylethanoylamino)benzoic acid

Systemtic Name: 2-[[2-carboxy-4-(2-iodanylethanoylamino)phenyl]diazenyl]-5-(2-iodanylethanoylamino)benzoic acid Openeye Name: 2-[2-carboxy-4-[(2-iodoacetyl)amino]phenyl]azo-5-[(2-iodoacetyl)amino]benzoic acid CAS Name: 2-[2-carboxy-4-[(2-iodo-1-oxoethyl)amino]phenyl]azo-5-[(2-iodo-1-oxoethyl)amino]benzoic acid IUPAC Name: 2-[[2-carboxy-4-[(2-iodoacetyl)amino]phenyl]diazenyl]-5-[(2-iodoacetyl)amino]benzoic acid Traditional Name: 2-[2-carboxy-4-[(2-iodoacetyl)amino]phenyl]azo-5-[(2-iodoacetyl)amino]benzoic acid Formula: C18H14I2N4O6 MolecularWeight: 636.1359

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CI)C(=O)O)N=NC2=C(C=C(C=C2)NC(=O)CI)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CI)C(=O)O)N=NC2=C(C=C(C=C2)NC(=O)CI)C(=O)O

InChI

InChI=1S/C18H14I2N4O6/c19-7-15(25)21-9-1-3-13(11(5-9)17(27)28)23-24-14-4-2-10(22-16(26)8-20)6-12(14)18(29)30/h1-6H,7-8H2,(H,21,25)(H,22,26)(H,27,28)(H,29,30)