tert-butyl 2-[5-iodanyl-2-oxidanylidene-3-(phenylmethoxycarbonylamino)pyridin-1-yl]ethanoate

Systemtic Name: tert-butyl 2-[5-iodanyl-2-oxidanylidene-3-(phenylmethoxycarbonylamino)pyridin-1-yl]ethanoate Openeye Name: tert-butyl 2-[3-(benzyloxycarbonylamino)-5-iodo-2-oxo-1-pyridyl]acetate CAS Name: 2-[5-iodo-2-oxo-3-(phenylmethoxycarbonylamino)-1-pyridinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[5-iodo-2-oxo-3-(phenylmethoxycarbonylamino)pyridin-1-yl]acetate Traditional Name: 2-[3-(benzyloxycarbonylamino)-5-iodo-2-keto-1-pyridyl]acetic acid tert-butyl ester Formula: C19H21IN2O5 MolecularWeight: 484.28491

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C=C(C=C(C1=O)NC(=O)OCC2=CC=CC=C2)I

Isomeric SMILES

CC(C)(C)OC(=O)CN1C=C(C=C(C1=O)NC(=O)OCC2=CC=CC=C2)I

InChI

InChI=1S/C19H21IN2O5/c1-19(2,3)27-16(23)11-22-10-14(20)9-15(17(22)24)21-18(25)26-12-13-7-5-4-6-8-13/h4-10H,11-12H2,1-3H3,(H,21,25)