[2-[(5-bromanyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl] 5-iodanyl-2-oxidanyl-benzoate

Systemtic Name: [2-[(5-bromanyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl] 5-iodanyl-2-oxidanyl-benzoate Openeye Name: [2-[(5-bromothiazol-2-yl)amino]-2-oxo-ethyl] 2-hydroxy-5-iodo-benzoate CAS Name: 2-hydroxy-5-iodobenzoic acid [2-[(5-bromo-2-thiazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 2-hydroxy-5-iodobenzoate Traditional Name: 2-hydroxy-5-iodo-benzoic acid [2-[(5-bromothiazol-2-yl)amino]-2-keto-ethyl] ester Formula: C12H8BrIN2O4S MolecularWeight: 483.07639

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1I)C(=O)OCC(=O)NC2=NC=C(S2)Br)O

Isomeric SMILES

C1=CC(=C(C=C1I)C(=O)OCC(=O)NC2=NC=C(S2)Br)O

InChI

InChI=1S/C12H8BrIN2O4S/c13-9-4-15-12(21-9)16-10(18)5-20-11(19)7-3-6(14)1-2-8(7)17/h1-4,17H,5H2,(H,15,16,18)