4,5-bis(chloranyl)-2-(2-pyridin-4-ylethylcarbamoyl)benzoate

Systemtic Name: 4,5-bis(chloranyl)-2-(2-pyridin-4-ylethylcarbamoyl)benzoate Openeye Name: 4,5-dichloro-2-[2-(4-pyridyl)ethylcarbamoyl]benzoate CAS Name: 4,5-dichloro-2-[oxo-(2-pyridin-4-ylethylamino)methyl]benzoate IUPAC Name: 4,5-dichloro-2-(2-pyridin-4-ylethylcarbamoyl)benzoate Traditional Name: 4,5-dichloro-2-[2-(4-pyridyl)ethylcarbamoyl]benzoate Formula: C15H11Cl2N2O3- MolecularWeight: 338.16544

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CCNC(=O)C2=CC(=C(C=C2C(=O)[O-])Cl)Cl

Isomeric SMILES

C1=CN=CC=C1CCNC(=O)C2=CC(=C(C=C2C(=O)[O-])Cl)Cl

InChI

InChI=1S/C15H12Cl2N2O3/c16-12-7-10(11(15(21)22)8-13(12)17)14(20)19-6-3-9-1-4-18-5-2-9/h1-2,4-5,7-8H,3,6H2,(H,19,20)(H,21,22)/p-1