ethyl 2-[3-[2-(4-acetamidobutanoyl)-5-chloranyl-phenyl]propanoylamino]propanoate

Systemtic Name: ethyl 2-[3-[2-(4-acetamidobutanoyl)-5-chloranyl-phenyl]propanoylamino]propanoate Openeye Name: ethyl 2-[3-[2-(4-acetamidobutanoyl)-5-chloro-phenyl]propanoylamino]propanoate CAS Name: 2-[[3-[2-(4-acetamido-1-oxobutyl)-5-chlorophenyl]-1-oxopropyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 2-[3-[2-(4-acetamidobutanoyl)-5-chlorophenyl]propanoylamino]propanoate Traditional Name: 2-[3-[2-(4-acetamidobutanoyl)-5-chloro-phenyl]propanoylamino]propionic acid ethyl ester Formula: C20H27ClN2O5 MolecularWeight: 410.89178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)NC(=O)CCC1=C(C=CC(=C1)Cl)C(=O)CCCNC(=O)C

Isomeric SMILES

CCOC(=O)C(C)NC(=O)CCC1=C(C=CC(=C1)Cl)C(=O)CCCNC(=O)C

InChI

InChI=1S/C20H27ClN2O5/c1-4-28-20(27)13(2)23-19(26)10-7-15-12-16(21)8-9-17(15)18(25)6-5-11-22-14(3)24/h8-9,12-13H,4-7,10-11H2,1-3H3,(H,22,24)(H,23,26)