[6,6-bis(fluoranyl)-5-methyl-hex-5-enyl] 6-[(4-methylphenyl)sulfonylamino]pyridine-3-carboxylate

Systemtic Name: [6,6-bis(fluoranyl)-5-methyl-hex-5-enyl] 6-[(4-methylphenyl)sulfonylamino]pyridine-3-carboxylate Openeye Name: (6,6-difluoro-5-methyl-hex-5-enyl) 6-(p-tolylsulfonylamino)pyridine-3-carboxylate CAS Name: 6-[(4-methylphenyl)sulfonylamino]-3-pyridinecarboxylic acid (6,6-difluoro-5-methylhex-5-enyl) ester IUPAC Name: (6,6-difluoro-5-methylhex-5-enyl) 6-[(4-methylphenyl)sulfonylamino]pyridine-3-carboxylate Traditional Name: 6-(tosylamino)nicotinic acid (6,6-difluoro-5-methyl-hex-5-enyl) ester Formula: C20H22F2N2O4S MolecularWeight: 424.461486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC=C(C=C2)C(=O)OCCCCC(=C(F)F)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC=C(C=C2)C(=O)OCCCCC(=C(F)F)C

InChI

InChI=1S/C20H22F2N2O4S/c1-14-6-9-17(10-7-14)29(26,27)24-18-11-8-16(13-23-18)20(25)28-12-4-3-5-15(2)19(21)22/h6-11,13H,3-5,12H2,1-2H3,(H,23,24)