ethyl 3-chloranyl-4-[3-(3,4-diethoxyphenyl)propanoylamino]benzoate

Systemtic Name: ethyl 3-chloranyl-4-[3-(3,4-diethoxyphenyl)propanoylamino]benzoate Openeye Name: ethyl 3-chloro-4-[3-(3,4-diethoxyphenyl)propanoylamino]benzoate CAS Name: 3-chloro-4-[[3-(3,4-diethoxyphenyl)-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-chloro-4-[3-(3,4-diethoxyphenyl)propanoylamino]benzoate Traditional Name: 3-chloro-4-[3-(3,4-diethoxyphenyl)propanoylamino]benzoic acid ethyl ester Formula: C22H26ClNO5 MolecularWeight: 419.89854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCC(=O)NC2=C(C=C(C=C2)C(=O)OCC)Cl)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCC(=O)NC2=C(C=C(C=C2)C(=O)OCC)Cl)OCC

InChI

InChI=1S/C22H26ClNO5/c1-4-27-19-11-7-15(13-20(19)28-5-2)8-12-21(25)24-18-10-9-16(14-17(18)23)22(26)29-6-3/h7,9-11,13-14H,4-6,8,12H2,1-3H3,(H,24,25)