5-[[4-(ethylcarbamoyl)phenyl]sulfonylcarbamoyl]-4-heptyl-pyridine-2-carboxylic acid

Systemtic Name: 5-[[4-(ethylcarbamoyl)phenyl]sulfonylcarbamoyl]-4-heptyl-pyridine-2-carboxylic acid Openeye Name: 5-[[4-(ethylcarbamoyl)phenyl]sulfonylcarbamoyl]-4-heptyl-pyridine-2-carboxylic acid CAS Name: 5-[[[4-(ethylcarbamoyl)phenyl]sulfonylamino]-oxomethyl]-4-heptyl-2-pyridinecarboxylic acid IUPAC Name: 5-[[4-(ethylcarbamoyl)phenyl]sulfonylcarbamoyl]-4-heptylpyridine-2-carboxylic acid Traditional Name: 5-[[4-(ethylcarbamoyl)phenyl]sulfonylcarbamoyl]-4-heptyl-picolinic acid Formula: C23H29N3O6S MolecularWeight: 475.55786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC(=NC=C1C(=O)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCC)C(=O)O

Isomeric SMILES

CCCCCCCC1=CC(=NC=C1C(=O)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCC)C(=O)O

InChI

InChI=1S/C23H29N3O6S/c1-3-5-6-7-8-9-17-14-20(23(29)30)25-15-19(17)22(28)26-33(31,32)18-12-10-16(11-13-18)21(27)24-4-2/h10-15H,3-9H2,1-2H3,(H,24,27)(H,26,28)(H,29,30)