(3S)-3-(4-tert-butylphenyl)-3-[2-(4-chlorophenyl)ethanoylamino]propanoate

Systemtic Name: (3S)-3-(4-tert-butylphenyl)-3-[2-(4-chlorophenyl)ethanoylamino]propanoate Openeye Name: (3S)-3-(4-tert-butylphenyl)-3-[[2-(4-chlorophenyl)acetyl]amino]propanoate CAS Name: (3S)-3-(4-tert-butylphenyl)-3-[[2-(4-chlorophenyl)-1-oxoethyl]amino]propanoate IUPAC Name: (3S)-3-(4-tert-butylphenyl)-3-[[2-(4-chlorophenyl)acetyl]amino]propanoate Traditional Name: (3S)-3-(4-tert-butylphenyl)-3-[[2-(4-chlorophenyl)acetyl]amino]propionate Formula: C21H23ClNO3- MolecularWeight: 372.86522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(CC(=O)[O-])NC(=O)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)[C@H](CC(=O)[O-])NC(=O)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H24ClNO3/c1-21(2,3)16-8-6-15(7-9-16)18(13-20(25)26)23-19(24)12-14-4-10-17(22)11-5-14/h4-11,18H,12-13H2,1-3H3,(H,23,24)(H,25,26)/p-1/t18-/m0/s1