tert-butyl N-[3-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]-1-oxidanylidene-1-phenylazanyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[3-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]-1-oxidanylidene-1-phenylazanyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[2-anilino-1-[(4-hydroxy-3,5-diiodo-phenyl)methyl]-2-oxo-ethyl]carbamate CAS Name: N-[1-anilino-3-(4-hydroxy-3,5-diiodophenyl)-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-anilino-3-(4-hydroxy-3,5-diiodophenyl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-anilino-1-(4-hydroxy-3,5-diiodo-benzyl)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C20H22I2N2O4 MolecularWeight: 608.20862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC(=C(C(=C1)I)O)I)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC(=C(C(=C1)I)O)I)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C20H22I2N2O4/c1-20(2,3)28-19(27)24-16(18(26)23-13-7-5-4-6-8-13)11-12-9-14(21)17(25)15(22)10-12/h4-10,16,25H,11H2,1-3H3,(H,23,26)(H,24,27)