2-[4-(2,5-dimethylphenoxy)butanoylamino]benzoic acid

Systemtic Name: 2-[4-(2,5-dimethylphenoxy)butanoylamino]benzoic acid Openeye Name: 2-[4-(2,5-dimethylphenoxy)butanoylamino]benzoic acid CAS Name: 2-[[4-(2,5-dimethylphenoxy)-1-oxobutyl]amino]benzoic acid IUPAC Name: 2-[4-(2,5-dimethylphenoxy)butanoylamino]benzoic acid Traditional Name: 2-[4-(2,5-dimethylphenoxy)butanoylamino]benzoic acid Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCCC(=O)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCCC(=O)NC2=CC=CC=C2C(=O)O

InChI

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