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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)CNC(=O)C2=C(C=CC(=C2)C3=C(N=CC=C3)C(=O)O)Cl

Isomeric SMILES

C1CCCC(CC1)CNC(=O)C2=C(C=CC(=C2)C3=C(N=CC=C3)C(=O)O)Cl

InChI

InChI=1S/C21H23ClN2O3/c22-18-10-9-15(16-8-5-11-23-19(16)21(26)27)12-17(18)20(25)24-13-14-6-3-1-2-4-7-14/h5,8-12,14H,1-4,6-7,13H2,(H,24,25)(H,26,27)