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

Systemtic Name: 3-[4-(4-ethylphenoxy)butanoylamino]benzoic acid Openeye Name: 3-[4-(4-ethylphenoxy)butanoylamino]benzoic acid CAS Name: 3-[[4-(4-ethylphenoxy)-1-oxobutyl]amino]benzoic acid IUPAC Name: 3-[4-(4-ethylphenoxy)butanoylamino]benzoic acid Traditional Name: 3-[4-(4-ethylphenoxy)butanoylamino]benzoic acid Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCCCC(=O)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)OCCCC(=O)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C19H21NO4/c1-2-14-8-10-17(11-9-14)24-12-4-7-18(21)20-16-6-3-5-15(13-16)19(22)23/h3,5-6,8-11,13H,2,4,7,12H2,1H3,(H,20,21)(H,22,23)