3-[4-chloranyl-3-(2-cyclohexylethylcarbamoyl)phenyl]pyridine-2-carboxylic acid

Systemtic Name: 3-[4-chloranyl-3-(2-cyclohexylethylcarbamoyl)phenyl]pyridine-2-carboxylic acid Openeye Name: 3-[4-chloro-3-(2-cyclohexylethylcarbamoyl)phenyl]pyridine-2-carboxylic acid CAS Name: 3-[4-chloro-3-[(2-cyclohexylethylamino)-oxomethyl]phenyl]-2-pyridinecarboxylic acid IUPAC Name: 3-[4-chloro-3-(2-cyclohexylethylcarbamoyl)phenyl]pyridine-2-carboxylic acid Traditional Name: 3-[4-chloro-3-(2-cyclohexylethylcarbamoyl)phenyl]picolinic acid Formula: C21H23ClN2O3 MolecularWeight: 386.87192

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCNC(=O)C2=C(C=CC(=C2)C3=C(N=CC=C3)C(=O)O)Cl

Isomeric SMILES

C1CCC(CC1)CCNC(=O)C2=C(C=CC(=C2)C3=C(N=CC=C3)C(=O)O)Cl

InChI

InChI=1S/C21H23ClN2O3/c22-18-9-8-15(16-7-4-11-23-19(16)21(26)27)13-17(18)20(25)24-12-10-14-5-2-1-3-6-14/h4,7-9,11,13-14H,1-3,5-6,10,12H2,(H,24,25)(H,26,27)