5-[[4-[2-(pentanoylamino)ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate

Systemtic Name: 5-[[4-[2-(pentanoylamino)ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: 5-[[4-[2-(pentanoylamino)ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[oxo-[[4-[2-(1-oxopentylamino)ethyl]phenyl]sulfonylamino]methyl]-2-pyridinecarboxylate IUPAC Name: 5-[[4-[2-(pentanoylamino)ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[4-[2-(valerylamino)ethyl]phenyl]sulfonylcarbamoyl]picolinate Formula: C20H22N3O6S- MolecularWeight: 432.47018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NCCC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CN=C(C=C2)C(=O)[O-]

Isomeric SMILES

CCCCC(=O)NCCC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CN=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C20H23N3O6S/c1-2-3-4-18(24)21-12-11-14-5-8-16(9-6-14)30(28,29)23-19(25)15-7-10-17(20(26)27)22-13-15/h5-10,13H,2-4,11-12H2,1H3,(H,21,24)(H,23,25)(H,26,27)/p-1