6-[[3-[(2-fluorophenyl)sulfonylmethyl]-5-propan-2-yloxy-phenyl]carbonylamino]pyridine-3-carboxylic acid

Systemtic Name: 6-[[3-[(2-fluorophenyl)sulfonylmethyl]-5-propan-2-yloxy-phenyl]carbonylamino]pyridine-3-carboxylic acid Openeye Name: 6-[[3-[(2-fluorophenyl)sulfonylmethyl]-5-isopropoxy-benzoyl]amino]pyridine-3-carboxylic acid CAS Name: 6-[[[3-[(2-fluorophenyl)sulfonylmethyl]-5-propan-2-yloxyphenyl]-oxomethyl]amino]-3-pyridinecarboxylic acid IUPAC Name: 6-[[3-[(2-fluorophenyl)sulfonylmethyl]-5-propan-2-yloxybenzoyl]amino]pyridine-3-carboxylic acid Traditional Name: 6-[[3-[(2-fluorophenyl)sulfonylmethyl]-5-isopropoxy-benzoyl]amino]nicotinic acid Formula: C23H21FN2O6S MolecularWeight: 472.486043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=CC(=C1)CS(=O)(=O)C2=CC=CC=C2F)C(=O)NC3=NC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C)OC1=CC(=CC(=C1)CS(=O)(=O)C2=CC=CC=C2F)C(=O)NC3=NC=C(C=C3)C(=O)O

InChI

InChI=1S/C23H21FN2O6S/c1-14(2)32-18-10-15(13-33(30,31)20-6-4-3-5-19(20)24)9-17(11-18)22(27)26-21-8-7-16(12-25-21)23(28)29/h3-12,14H,13H2,1-2H3,(H,28,29)(H,25,26,27)