(2S)-2-acetamido-3-[3-iodanyl-4-(4-methoxyphenoxy)phenyl]propanamide

Systemtic Name: (2S)-2-acetamido-3-[3-iodanyl-4-(4-methoxyphenoxy)phenyl]propanamide Openeye Name: (2S)-2-acetamido-3-[3-iodo-4-(4-methoxyphenoxy)phenyl]propanamide CAS Name: (2S)-2-acetamido-3-[3-iodo-4-(4-methoxyphenoxy)phenyl]propanamide IUPAC Name: (2S)-2-acetamido-3-[3-iodo-4-(4-methoxyphenoxy)phenyl]propanamide Traditional Name: (2S)-2-acetamido-3-[3-iodo-4-(4-methoxyphenoxy)phenyl]propionamide Formula: C18H19IN2O4 MolecularWeight: 454.25893

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC(=C(C=C1)OC2=CC=C(C=C2)OC)I)C(=O)N

Isomeric SMILES

CC(=O)N[C@@H](CC1=CC(=C(C=C1)OC2=CC=C(C=C2)OC)I)C(=O)N

InChI

InChI=1S/C18H19IN2O4/c1-11(22)21-16(18(20)23)10-12-3-8-17(15(19)9-12)25-14-6-4-13(24-2)5-7-14/h3-9,16H,10H2,1-2H3,(H2,20,23)(H,21,22)/t16-/m0/s1