2-(4-chloranyl-2,6-dimethyl-phenoxy)-4-ethyl-1-methoxy-6-methyl-2-(propylamino)pyridine-3-carboxylic acid

Systemtic Name: 2-(4-chloranyl-2,6-dimethyl-phenoxy)-4-ethyl-1-methoxy-6-methyl-2-(propylamino)pyridine-3-carboxylic acid Openeye Name: 2-(4-chloro-2,6-dimethyl-phenoxy)-4-ethyl-1-methoxy-6-methyl-2-(propylamino)pyridine-3-carboxylic acid CAS Name: 2-(4-chloro-2,6-dimethylphenoxy)-4-ethyl-1-methoxy-6-methyl-2-(propylamino)-3-pyridinecarboxylic acid IUPAC Name: 2-(4-chloro-2,6-dimethylphenoxy)-4-ethyl-1-methoxy-6-methyl-2-(propylamino)pyridine-3-carboxylic acid Traditional Name: 2-(4-chloro-2,6-dimethyl-phenoxy)-4-ethyl-1-methoxy-6-methyl-2-(propylamino)nicotinic acid Formula: C21H29ClN2O4 MolecularWeight: 408.91896

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1(C(=C(C=C(N1OC)C)CC)C(=O)O)OC2=C(C=C(C=C2C)Cl)C

Isomeric SMILES

CCCNC1(C(=C(C=C(N1OC)C)CC)C(=O)O)OC2=C(C=C(C=C2C)Cl)C

InChI

InChI=1S/C21H29ClN2O4/c1-7-9-23-21(28-19-13(3)10-17(22)11-14(19)4)18(20(25)26)16(8-2)12-15(5)24(21)27-6/h10-12,23H,7-9H2,1-6H3,(H,25,26)