4-chloranyl-2-(4-pyridin-3-ylbutylcarbamoyl)benzoic acid

Systemtic Name: 4-chloranyl-2-(4-pyridin-3-ylbutylcarbamoyl)benzoic acid Openeye Name: 4-chloro-2-[4-(3-pyridyl)butylcarbamoyl]benzoic acid CAS Name: 4-chloro-2-[oxo-[4-(3-pyridinyl)butylamino]methyl]benzoic acid IUPAC Name: 4-chloro-2-(4-pyridin-3-ylbutylcarbamoyl)benzoic acid Traditional Name: 4-chloro-2-[4-(3-pyridyl)butylcarbamoyl]benzoic acid Formula: C17H17ClN2O3 MolecularWeight: 332.78148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCCCNC(=O)C2=C(C=CC(=C2)Cl)C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)CCCCNC(=O)C2=C(C=CC(=C2)Cl)C(=O)O

InChI

InChI=1S/C17H17ClN2O3/c18-13-6-7-14(17(22)23)15(10-13)16(21)20-9-2-1-4-12-5-3-8-19-11-12/h3,5-8,10-11H,1-2,4,9H2,(H,20,21)(H,22,23)