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

Systemtic Name: 5-chloranyl-2-[4-chloranyl-3-(cycloheptylmethylcarbamoyl)phenyl]pyridine-3-carboxylic acid Openeye Name: 5-chloro-2-[4-chloro-3-(cycloheptylmethylcarbamoyl)phenyl]pyridine-3-carboxylic acid CAS Name: 5-chloro-2-[4-chloro-3-[(cycloheptylmethylamino)-oxomethyl]phenyl]-3-pyridinecarboxylic acid IUPAC Name: 5-chloro-2-[4-chloro-3-(cycloheptylmethylcarbamoyl)phenyl]pyridine-3-carboxylic acid Traditional Name: 5-chloro-2-[4-chloro-3-(cycloheptylmethylcarbamoyl)phenyl]nicotinic acid Formula: C21H22Cl2N2O3 MolecularWeight: 421.31698

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)CNC(=O)C2=C(C=CC(=C2)C3=NC=C(C=C3C(=O)O)Cl)Cl

Isomeric SMILES

C1CCCC(CC1)CNC(=O)C2=C(C=CC(=C2)C3=NC=C(C=C3C(=O)O)Cl)Cl

InChI

InChI=1S/C21H22Cl2N2O3/c22-15-10-17(21(27)28)19(24-12-15)14-7-8-18(23)16(9-14)20(26)25-11-13-5-3-1-2-4-6-13/h7-10,12-13H,1-6,11H2,(H,25,26)(H,27,28)