3-(5-chloranylpentanoylamino)benzoic acid

Systemtic Name: 3-(5-chloranylpentanoylamino)benzoic acid Openeye Name: 3-(5-chloropentanoylamino)benzoic acid CAS Name: 3-[(5-chloro-1-oxopentyl)amino]benzoic acid IUPAC Name: 3-(5-chloropentanoylamino)benzoic acid Traditional Name: 3-(5-chloropentanoylamino)benzoic acid Formula: C12H14ClNO3 MolecularWeight: 255.69746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCCCCl)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCCCCl)C(=O)O

InChI

InChI=1S/C12H14ClNO3/c13-7-2-1-6-11(15)14-10-5-3-4-9(8-10)12(16)17/h3-5,8H,1-2,6-7H2,(H,14,15)(H,16,17)