sodium 3,5-bis(iodanyl)-4-[(phenylmethyl)amino]benzoic acid

Systemtic Name: sodium 3,5-bis(iodanyl)-4-[(phenylmethyl)amino]benzoic acid Openeye Name: sodium 4-(benzylamino)-3,5-diiodo-benzoic acid CAS Name: sodium 3,5-diiodo-4-[(phenylmethyl)amino]benzoic acid IUPAC Name: sodium 4-(benzylamino)-3,5-diiodobenzoic acid Traditional Name: sodium 4-(benzylamino)-3,5-diiodo-benzoic acid Formula: C14H11I2NNaO2+ MolecularWeight: 502.04135

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=C(C=C2I)C(=O)O)I.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=C(C=C2I)C(=O)O)I.[Na+]

InChI

InChI=1S/C14H11I2NO2.Na/c15-11-6-10(14(18)19)7-12(16)13(11)17-8-9-4-2-1-3-5-9;/h1-7,17H,8H2,(H,18,19);/q;+1