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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCC(=O)NC(CC(=O)OC)C2=CC=CC=C2Cl

Isomeric SMILES

CC1=CC(=CC=C1)OCCCC(=O)N[C@@H](CC(=O)OC)C2=CC=CC=C2Cl

InChI

InChI=1S/C21H24ClNO4/c1-15-7-5-8-16(13-15)27-12-6-11-20(24)23-19(14-21(25)26-2)17-9-3-4-10-18(17)22/h3-5,7-10,13,19H,6,11-12,14H2,1-2H3,(H,23,24)/t19-/m0/s1