3-[4-(4-chloranylphenoxy)butanoylamino]benzoic acid

Systemtic Name: 3-[4-(4-chloranylphenoxy)butanoylamino]benzoic acid Openeye Name: 3-[4-(4-chlorophenoxy)butanoylamino]benzoic acid CAS Name: 3-[[4-(4-chlorophenoxy)-1-oxobutyl]amino]benzoic acid IUPAC Name: 3-[4-(4-chlorophenoxy)butanoylamino]benzoic acid Traditional Name: 3-[4-(4-chlorophenoxy)butanoylamino]benzoic acid Formula: C17H16ClNO4 MolecularWeight: 333.76624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCCOC2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCCOC2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C17H16ClNO4/c18-13-6-8-15(9-7-13)23-10-2-5-16(20)19-14-4-1-3-12(11-14)17(21)22/h1,3-4,6-9,11H,2,5,10H2,(H,19,20)(H,21,22)