methyl (3S)-3-(4-chlorophenyl)-3-[4-(2-methylphenoxy)butanoylamino]propanoate

Systemtic Name: methyl (3S)-3-(4-chlorophenyl)-3-[4-(2-methylphenoxy)butanoylamino]propanoate Openeye Name: methyl (3S)-3-(4-chlorophenyl)-3-[4-(2-methylphenoxy)butanoylamino]propanoate CAS Name: (3S)-3-(4-chlorophenyl)-3-[[4-(2-methylphenoxy)-1-oxobutyl]amino]propanoic acid methyl ester IUPAC Name: methyl (3S)-3-(4-chlorophenyl)-3-[4-(2-methylphenoxy)butanoylamino]propanoate Traditional Name: (3S)-3-(4-chlorophenyl)-3-[4-(2-methylphenoxy)butanoylamino]propionic acid methyl ester Formula: C21H24ClNO4 MolecularWeight: 389.87256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCC(=O)NC(CC(=O)OC)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC=CC=C1OCCCC(=O)N[C@@H](CC(=O)OC)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H24ClNO4/c1-15-6-3-4-7-19(15)27-13-5-8-20(24)23-18(14-21(25)26-2)16-9-11-17(22)12-10-16/h3-4,6-7,9-12,18H,5,8,13-14H2,1-2H3,(H,23,24)/t18-/m0/s1