8-[2-[(4-chlorophenyl)carbonylamino]phenyl]carbonyloxy-7-iodanyl-quinoline-5-sulfonic acid

Systemtic Name: 8-[2-[(4-chlorophenyl)carbonylamino]phenyl]carbonyloxy-7-iodanyl-quinoline-5-sulfonic acid Openeye Name: 8-[2-[(4-chlorobenzoyl)amino]benzoyl]oxy-7-iodo-quinoline-5-sulfonic acid CAS Name: 8-[[2-[[(4-chlorophenyl)-oxomethyl]amino]phenyl]-oxomethoxy]-7-iodo-5-quinolinesulfonic acid IUPAC Name: 8-[2-[(4-chlorobenzoyl)amino]benzoyl]oxy-7-iodoquinoline-5-sulfonic acid Traditional Name: 8-[2-[(4-chlorobenzoyl)amino]benzoyl]oxy-7-iodo-quinoline-5-sulfonic acid Formula: C23H14ClIN2O6S MolecularWeight: 608.78953

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OC2=C(C=C(C3=C2N=CC=C3)S(=O)(=O)O)I)NC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OC2=C(C=C(C3=C2N=CC=C3)S(=O)(=O)O)I)NC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H14ClIN2O6S/c24-14-9-7-13(8-10-14)22(28)27-18-6-2-1-4-15(18)23(29)33-21-17(25)12-19(34(30,31)32)16-5-3-11-26-20(16)21/h1-12H,(H,27,28)(H,30,31,32)