ethyl 2-chloranyl-4-[2-(2,5-dimethylphenoxy)butanoylamino]benzoate

Systemtic Name: ethyl 2-chloranyl-4-[2-(2,5-dimethylphenoxy)butanoylamino]benzoate Openeye Name: ethyl 2-chloro-4-[2-(2,5-dimethylphenoxy)butanoylamino]benzoate CAS Name: 2-chloro-4-[[2-(2,5-dimethylphenoxy)-1-oxobutyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-chloro-4-[2-(2,5-dimethylphenoxy)butanoylamino]benzoate Traditional Name: 2-chloro-4-[2-(2,5-dimethylphenoxy)butanoylamino]benzoic acid ethyl ester Formula: C21H24ClNO4 MolecularWeight: 389.87256

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=C(C=C1)C(=O)OCC)Cl)OC2=C(C=CC(=C2)C)C

Isomeric SMILES

CCC(C(=O)NC1=CC(=C(C=C1)C(=O)OCC)Cl)OC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C21H24ClNO4/c1-5-18(27-19-11-13(3)7-8-14(19)4)20(24)23-15-9-10-16(17(22)12-15)21(25)26-6-2/h7-12,18H,5-6H2,1-4H3,(H,23,24)