(4-nitrophenyl)methyl N-(2-methyl-1-sulfanyl-propan-2-yl)carbamate

Systemtic Name: (4-nitrophenyl)methyl N-(2-methyl-1-sulfanyl-propan-2-yl)carbamate Openeye Name: (4-nitrophenyl)methyl N-(1,1-dimethyl-2-sulfanyl-ethyl)carbamate CAS Name: N-(1-mercapto-2-methylpropan-2-yl)carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-(2-methyl-1-sulfanylpropan-2-yl)carbamate Traditional Name: N-(2-mercapto-1,1-dimethyl-ethyl)carbamic acid (4-nitrobenzyl) ester Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CS)NC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(CS)NC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O4S/c1-12(2,8-19)13-11(15)18-7-9-3-5-10(6-4-9)14(16)17/h3-6,19H,7-8H2,1-2H3,(H,13,15)