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2-(4-methoxy-2,6-dimethyl-phenoxy)-6-methyl-4-[methylsulfonyloxymethyl(propyl)amino]pyridine-3-carboxylic acid

2-(4-methoxy-2,6-dimethyl-phenoxy)-6-methyl-4-[methylsulfonyloxymethyl(propyl)amino]pyridine-3-carboxylic acid

Systemtic Name:2-(4-methoxy-2,6-dimethyl-phenoxy)-6-methyl-4-[methylsulfonyloxymethyl(propyl)amino]pyridine-3-carboxylic acid
Openeye Name:2-(4-methoxy-2,6-dimethyl-phenoxy)-6-methyl-4-[methylsulfonyloxymethyl(propyl)amino]pyridine-3-carboxylic acid
CAS Name:2-(4-methoxy-2,6-dimethylphenoxy)-6-methyl-4-[methylsulfonyloxymethyl(propyl)amino]-3-pyridinecarboxylic acid
IUPAC Name:2-(4-methoxy-2,6-dimethylphenoxy)-6-methyl-4-[methylsulfonyloxymethyl(propyl)amino]pyridine-3-carboxylic acid
Traditional Name:2-(4-methoxy-2,6-dimethyl-phenoxy)-6-methyl-4-[methylsulfonyloxymethyl(propyl)amino]nicotinic acid
Formula: C21H28N2O7S
MolecularWeight: 452.52122
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Descriptors Computed from Structure

Canonical SMILES:

CCCN(COS(=O)(=O)C)C1=CC(=NC(=C1C(=O)O)OC2=C(C=C(C=C2C)OC)C)C


Isomeric SMILES

CCCN(COS(=O)(=O)C)C1=CC(=NC(=C1C(=O)O)OC2=C(C=C(C=C2C)OC)C)C


InChI

InChI=1S/C21H28N2O7S/c1-7-8-23(12-29-31(6,26)27)17-11-15(4)22-20(18(17)21(24)25)30-19-13(2)9-16(28-5)10-14(19)3/h9-11H,7-8,12H2,1-6H3,(H,24,25)


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