methyl (2S)-2-benzamido-3-(4-iodophenyl)propanoate

Systemtic Name: methyl (2S)-2-benzamido-3-(4-iodophenyl)propanoate Openeye Name: methyl (2S)-2-benzamido-3-(4-iodophenyl)propanoate CAS Name: (2S)-2-benzamido-3-(4-iodophenyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-benzamido-3-(4-iodophenyl)propanoate Traditional Name: (2S)-2-benzamido-3-(4-iodophenyl)propionic acid methyl ester Formula: C17H16INO3 MolecularWeight: 409.21831

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)I)NC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)I)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H16INO3/c1-22-17(21)15(11-12-7-9-14(18)10-8-12)19-16(20)13-5-3-2-4-6-13/h2-10,15H,11H2,1H3,(H,19,20)/t15-/m0/s1