pentyl 2-azanyl-3-[3,5-bis(iodanyl)-4-methoxy-phenyl]propanoate

Systemtic Name: pentyl 2-azanyl-3-[3,5-bis(iodanyl)-4-methoxy-phenyl]propanoate Openeye Name: pentyl 2-amino-3-(3,5-diiodo-4-methoxy-phenyl)propanoate CAS Name: 2-amino-3-(3,5-diiodo-4-methoxyphenyl)propanoic acid pentyl ester IUPAC Name: pentyl 2-amino-3-(3,5-diiodo-4-methoxyphenyl)propanoate Traditional Name: 2-amino-3-(3,5-diiodo-4-methoxy-phenyl)propionic acid amyl ester Formula: C15H21I2NO3 MolecularWeight: 517.14108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C(CC1=CC(=C(C(=C1)I)OC)I)N

Isomeric SMILES

CCCCCOC(=O)C(CC1=CC(=C(C(=C1)I)OC)I)N

InChI

InChI=1S/C15H21I2NO3/c1-3-4-5-6-21-15(19)13(18)9-10-7-11(16)14(20-2)12(17)8-10/h7-8,13H,3-6,9,18H2,1-2H3