2-(3,5-dimethylphenoxy)ethyl 3-acetamido-3-(4-chlorophenyl)propanoate

Systemtic Name: 2-(3,5-dimethylphenoxy)ethyl 3-acetamido-3-(4-chlorophenyl)propanoate Openeye Name: 2-(3,5-dimethylphenoxy)ethyl 3-acetamido-3-(4-chlorophenyl)propanoate CAS Name: 3-acetamido-3-(4-chlorophenyl)propanoic acid 2-(3,5-dimethylphenoxy)ethyl ester IUPAC Name: 2-(3,5-dimethylphenoxy)ethyl 3-acetamido-3-(4-chlorophenyl)propanoate Traditional Name: 3-acetamido-3-(4-chlorophenyl)propionic acid 2-(3,5-dimethylphenoxy)ethyl ester Formula: C21H24ClNO4 MolecularWeight: 389.87256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCOC(=O)CC(C2=CC=C(C=C2)Cl)NC(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCOC(=O)CC(C2=CC=C(C=C2)Cl)NC(=O)C)C

InChI

InChI=1S/C21H24ClNO4/c1-14-10-15(2)12-19(11-14)26-8-9-27-21(25)13-20(23-16(3)24)17-4-6-18(22)7-5-17/h4-7,10-12,20H,8-9,13H2,1-3H3,(H,23,24)