2-(4-chloranyl-2-oxidanyl-phenoxy)-4-[ethyl(propyl)amino]-6-methyl-pyridine-3-carboxylic acid

Systemtic Name: 2-(4-chloranyl-2-oxidanyl-phenoxy)-4-[ethyl(propyl)amino]-6-methyl-pyridine-3-carboxylic acid Openeye Name: 2-(4-chloro-2-hydroxy-phenoxy)-4-[ethyl(propyl)amino]-6-methyl-pyridine-3-carboxylic acid CAS Name: 2-(4-chloro-2-hydroxyphenoxy)-4-[ethyl(propyl)amino]-6-methyl-3-pyridinecarboxylic acid IUPAC Name: 2-(4-chloro-2-hydroxyphenoxy)-4-[ethyl(propyl)amino]-6-methylpyridine-3-carboxylic acid Traditional Name: 2-(4-chloro-2-hydroxy-phenoxy)-4-[ethyl(propyl)amino]-6-methyl-nicotinic acid Formula: C18H21ClN2O4 MolecularWeight: 364.82334

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC)C1=CC(=NC(=C1C(=O)O)OC2=C(C=C(C=C2)Cl)O)C

Isomeric SMILES

CCCN(CC)C1=CC(=NC(=C1C(=O)O)OC2=C(C=C(C=C2)Cl)O)C

InChI

InChI=1S/C18H21ClN2O4/c1-4-8-21(5-2)13-9-11(3)20-17(16(13)18(23)24)25-15-7-6-12(19)10-14(15)22/h6-7,9-10,22H,4-5,8H2,1-3H3,(H,23,24)