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

Systemtic Name: 4-heptyl-5-[[4-[2-(2-methoxyphenyl)ethylcarbamoyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylic acid Openeye Name: 4-heptyl-5-[[4-[2-(2-methoxyphenyl)ethylcarbamoyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylic acid CAS Name: 4-heptyl-5-[[[4-[[2-(2-methoxyphenyl)ethylamino]-oxomethyl]phenyl]sulfonylamino]-oxomethyl]-2-pyridinecarboxylic acid IUPAC Name: 4-heptyl-5-[[4-[2-(2-methoxyphenyl)ethylcarbamoyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylic acid Traditional Name: 4-heptyl-5-[[4-[2-(2-methoxyphenyl)ethylcarbamoyl]phenyl]sulfonylcarbamoyl]picolinic acid Formula: C30H35N3O7S MolecularWeight: 581.6798

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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)NCCC3=CC=CC=C3OC)C(=O)O

Isomeric SMILES

CCCCCCCC1=CC(=NC=C1C(=O)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC3=CC=CC=C3OC)C(=O)O

InChI

InChI=1S/C30H35N3O7S/c1-3-4-5-6-7-11-23-19-26(30(36)37)32-20-25(23)29(35)33-41(38,39)24-15-13-22(14-16-24)28(34)31-18-17-21-10-8-9-12-27(21)40-2/h8-10,12-16,19-20H,3-7,11,17-18H2,1-2H3,(H,31,34)(H,33,35)(H,36,37)