(phenylmethyl) N-tert-butyl-N-(3-oxidanyl-1-oxidanylidene-1-thionitroso-propan-2-yl)carbamate

Systemtic Name: (phenylmethyl) N-tert-butyl-N-(3-oxidanyl-1-oxidanylidene-1-thionitroso-propan-2-yl)carbamate Openeye Name: benzyl N-tert-butyl-N-[1-(hydroxymethyl)-2-oxo-2-thionitroso-ethyl]carbamate CAS Name: N-tert-butyl-N-(3-hydroxy-1-oxo-1-thionitrosopropan-2-yl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-tert-butyl-N-(3-hydroxy-1-oxo-1-thionitrosopropan-2-yl)carbamate Traditional Name: N-tert-butyl-N-(2-keto-1-methylol-2-thionitroso-ethyl)carbamic acid benzyl ester Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(C(CO)C(=O)N=S)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)N(C(CO)C(=O)N=S)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C15H20N2O4S/c1-15(2,3)17(12(9-18)13(19)16-22)14(20)21-10-11-7-5-4-6-8-11/h4-8,12,18H,9-10H2,1-3H3