tert-butyl N-[(2S)-1-[(4-iodophenyl)amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[(4-iodophenyl)amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-(hydroxymethyl)-2-(4-iodoanilino)-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-3-hydroxy-1-(4-iodoanilino)-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-3-hydroxy-1-(4-iodoanilino)-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-2-(4-iodoanilino)-2-keto-1-methylol-ethyl]carbamic acid tert-butyl ester Formula: C14H19IN2O4 MolecularWeight: 406.21613

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CO)C(=O)NC1=CC=C(C=C1)I

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CO)C(=O)NC1=CC=C(C=C1)I

InChI

InChI=1S/C14H19IN2O4/c1-14(2,3)21-13(20)17-11(8-18)12(19)16-10-6-4-9(15)5-7-10/h4-7,11,18H,8H2,1-3H3,(H,16,19)(H,17,20)/t11-/m0/s1