methyl 4-[2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]ethyl]benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NCCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NCCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C21H24ClNO4/c1-15-14-18(22)9-10-19(15)27-13-3-4-20(24)23-12-11-16-5-7-17(8-6-16)21(25)26-2/h5-10,14H,3-4,11-13H2,1-2H3,(H,23,24)