5-[[3-(2-acetamidoethyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate

Systemtic Name: 5-[[3-(2-acetamidoethyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: 5-[[3-(2-acetamidoethyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[[[3-(2-acetamidoethyl)phenyl]sulfonylamino]-oxomethyl]-2-pyridinecarboxylate IUPAC Name: 5-[[3-(2-acetamidoethyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[3-(2-acetamidoethyl)phenyl]sulfonylcarbamoyl]picolinate Formula: C17H16N3O6S- MolecularWeight: 390.39044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O6S/c1-11(21)18-8-7-12-3-2-4-14(9-12)27(25,26)20-16(22)13-5-6-15(17(23)24)19-10-13/h2-6,9-10H,7-8H2,1H3,(H,18,21)(H,20,22)(H,23,24)/p-1