disodium 2-[(4-iodophenyl)carbonylamino]pentanedioate

Systemtic Name: disodium 2-[(4-iodophenyl)carbonylamino]pentanedioate Openeye Name: disodium 2-[(4-iodobenzoyl)amino]pentanedioate CAS Name: disodium 2-[[(4-iodophenyl)-oxomethyl]amino]pentanedioate IUPAC Name: disodium 2-[(4-iodobenzoyl)amino]pentanedioate Traditional Name: disodium 2-[(4-iodobenzoyl)amino]glutarate Formula: C12H10INNa2O5 MolecularWeight: 421.09551

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(CCC(=O)[O-])C(=O)[O-])I.[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(CCC(=O)[O-])C(=O)[O-])I.[Na+].[Na+]

InChI

InChI=1S/C12H12INO5.2Na/c13-8-3-1-7(2-4-8)11(17)14-9(12(18)19)5-6-10(15)16;;/h1-4,9H,5-6H2,(H,14,17)(H,15,16)(H,18,19);;/q;2*+1/p-2