5-(4-azanylbutanoylamino)-2-chloranyl-benzoic acid

Systemtic Name: 5-(4-azanylbutanoylamino)-2-chloranyl-benzoic acid Openeye Name: 5-(4-aminobutanoylamino)-2-chloro-benzoic acid CAS Name: 5-[(4-amino-1-oxobutyl)amino]-2-chlorobenzoic acid IUPAC Name: 5-(4-aminobutanoylamino)-2-chlorobenzoic acid Traditional Name: 5-(4-aminobutanoylamino)-2-chloro-benzoic acid Formula: C11H13ClN2O3 MolecularWeight: 256.68552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CCCN)C(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CCCN)C(=O)O)Cl

InChI

InChI=1S/C11H13ClN2O3/c12-9-4-3-7(6-8(9)11(16)17)14-10(15)2-1-5-13/h3-4,6H,1-2,5,13H2,(H,14,15)(H,16,17)