ethyl 3-chloranyl-4-[2-(3,4-dimethylphenoxy)butanoylamino]benzoate

Systemtic Name: ethyl 3-chloranyl-4-[2-(3,4-dimethylphenoxy)butanoylamino]benzoate Openeye Name: ethyl 3-chloro-4-[2-(3,4-dimethylphenoxy)butanoylamino]benzoate CAS Name: 3-chloro-4-[[2-(3,4-dimethylphenoxy)-1-oxobutyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-chloro-4-[2-(3,4-dimethylphenoxy)butanoylamino]benzoate Traditional Name: 3-chloro-4-[2-(3,4-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=C(C=C(C=C1)C(=O)OCC)Cl)OC2=CC(=C(C=C2)C)C

Isomeric SMILES

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

InChI

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