tert-butyl (3R)-3-(4-iodophenyl)-3-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]propanoate

Systemtic Name: tert-butyl (3R)-3-(4-iodophenyl)-3-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]propanoate Openeye Name: tert-butyl (3R)-3-(4-iodophenyl)-3-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]propanoate CAS Name: (3R)-3-(4-iodophenyl)-3-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-3-(4-iodophenyl)-3-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]propanoate Traditional Name: (3R)-3-(4-iodophenyl)-3-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]propionic acid tert-butyl ester Formula: C22H28INO3 MolecularWeight: 481.36709

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OC)NC(CC(=O)OC(C)(C)C)C2=CC=C(C=C2)I

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)OC)N[C@H](CC(=O)OC(C)(C)C)C2=CC=C(C=C2)I

InChI

InChI=1S/C22H28INO3/c1-15(16-8-12-19(26-5)13-9-16)24-20(14-21(25)27-22(2,3)4)17-6-10-18(23)11-7-17/h6-13,15,20,24H,14H2,1-5H3/t15-,20+/m0/s1