ethyl 2-acetamido-3-(2-iodanyl-1H-indol-3-yl)propanoate

Systemtic Name: ethyl 2-acetamido-3-(2-iodanyl-1H-indol-3-yl)propanoate Openeye Name: ethyl 2-acetamido-3-(2-iodo-1H-indol-3-yl)propanoate CAS Name: 2-acetamido-3-(2-iodo-1H-indol-3-yl)propanoic acid ethyl ester IUPAC Name: ethyl 2-acetamido-3-(2-iodo-1H-indol-3-yl)propanoate Traditional Name: 2-acetamido-3-(2-iodo-1H-indol-3-yl)propionic acid ethyl ester Formula: C15H17IN2O3 MolecularWeight: 400.21155

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=C(NC2=CC=CC=C21)I)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=C(NC2=CC=CC=C21)I)NC(=O)C

InChI

InChI=1S/C15H17IN2O3/c1-3-21-15(20)13(17-9(2)19)8-11-10-6-4-5-7-12(10)18-14(11)16/h4-7,13,18H,3,8H2,1-2H3,(H,17,19)