sodium 2-[5-aminocarbonyl-9-[(3-iodanylphenyl)methyl]carbazol-4-yl]oxyethanoate

Systemtic Name: sodium 2-[5-aminocarbonyl-9-[(3-iodanylphenyl)methyl]carbazol-4-yl]oxyethanoate Openeye Name: sodium 2-[5-carbamoyl-9-[(3-iodophenyl)methyl]carbazol-4-yl]oxyacetate CAS Name: sodium 2-[[5-carbamoyl-9-[(3-iodophenyl)methyl]-4-carbazolyl]oxy]acetate IUPAC Name: sodium 2-[5-carbamoyl-9-[(3-iodophenyl)methyl]carbazol-4-yl]oxyacetate Traditional Name: sodium 2-[5-carbamoyl-9-(3-iodobenzyl)carbazol-4-yl]oxyacetate Formula: C22H16IN2NaO4 MolecularWeight: 522.26768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)CN2C3=C(C(=CC=C3)OCC(=O)[O-])C4=C(C=CC=C42)C(=O)N.[Na+]

Isomeric SMILES

C1=CC(=CC(=C1)I)CN2C3=C(C(=CC=C3)OCC(=O)[O-])C4=C(C=CC=C42)C(=O)N.[Na+]

InChI

InChI=1S/C22H17IN2O4.Na/c23-14-5-1-4-13(10-14)11-25-16-7-2-6-15(22(24)28)20(16)21-17(25)8-3-9-18(21)29-12-19(26)27;/h1-10H,11-12H2,(H2,24,28)(H,26,27);/q;+1/p-1