5-[[2-chloranyl-4-(phenethylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate

Systemtic Name: 5-[[2-chloranyl-4-(phenethylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: 5-[[2-chloro-4-(phenethylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[[[2-chloro-4-[oxo-(phenethylamino)methyl]phenyl]sulfonylamino]-oxomethyl]-2-pyridinecarboxylate IUPAC Name: 5-[[2-chloro-4-(phenethylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[2-chloro-4-(phenethylcarbamoyl)phenyl]sulfonylcarbamoyl]picolinate Formula: C22H17ClN3O6S- MolecularWeight: 486.90488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=CC(=C(C=C2)S(=O)(=O)NC(=O)C3=CN=C(C=C3)C(=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=CC(=C(C=C2)S(=O)(=O)NC(=O)C3=CN=C(C=C3)C(=O)[O-])Cl

InChI

InChI=1S/C22H18ClN3O6S/c23-17-12-15(20(27)24-11-10-14-4-2-1-3-5-14)7-9-19(17)33(31,32)26-21(28)16-6-8-18(22(29)30)25-13-16/h1-9,12-13H,10-11H2,(H,24,27)(H,26,28)(H,29,30)/p-1