(4-nitrophenyl)methyl N-(2-methyl-2-sulfanyl-propyl)carbamate

Systemtic Name: (4-nitrophenyl)methyl N-(2-methyl-2-sulfanyl-propyl)carbamate Openeye Name: (4-nitrophenyl)methyl N-(2-methyl-2-sulfanyl-propyl)carbamate CAS Name: N-(2-mercapto-2-methylpropyl)carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-(2-methyl-2-sulfanylpropyl)carbamate Traditional Name: N-(2-mercapto-2-methyl-propyl)carbamic acid (4-nitrobenzyl) ester Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])S

Isomeric SMILES

CC(C)(CNC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])S

InChI

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