methyl N-[1-[[1-(3-iodanyl-4-oxidanyl-phenyl)-3-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: methyl N-[1-[[1-(3-iodanyl-4-oxidanyl-phenyl)-3-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: methyl N-[1-benzyl-2-[[1-[(4-hydroxy-3-iodo-phenyl)methyl]-2-oxo-propyl]amino]-2-oxo-ethyl]carbamate CAS Name: N-[1-[[1-(4-hydroxy-3-iodophenyl)-3-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamic acid methyl ester IUPAC Name: methyl N-[1-[[1-(4-hydroxy-3-iodophenyl)-3-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-[[1-(4-hydroxy-3-iodo-benzyl)-2-keto-propyl]amino]-2-keto-ethyl]carbamic acid methyl ester Formula: C21H23IN2O5 MolecularWeight: 510.32219

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC(=C(C=C1)O)I)NC(=O)C(CC2=CC=CC=C2)NC(=O)OC

Isomeric SMILES

CC(=O)C(CC1=CC(=C(C=C1)O)I)NC(=O)C(CC2=CC=CC=C2)NC(=O)OC

InChI

InChI=1S/C21H23IN2O5/c1-13(25)17(12-15-8-9-19(26)16(22)10-15)23-20(27)18(24-21(28)29-2)11-14-6-4-3-5-7-14/h3-10,17-18,26H,11-12H2,1-2H3,(H,23,27)(H,24,28)