(4-nitrophenyl)methyl N-(2-sulfanylethyl)carbamate

Systemtic Name: (4-nitrophenyl)methyl N-(2-sulfanylethyl)carbamate Openeye Name: (4-nitrophenyl)methyl N-(2-sulfanylethyl)carbamate CAS Name: N-(2-mercaptoethyl)carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-(2-sulfanylethyl)carbamate Traditional Name: N-(2-mercaptoethyl)carbamic acid (4-nitrobenzyl) ester Formula: C10H12N2O4S MolecularWeight: 256.27828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)NCCS)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC(=O)NCCS)[N+](=O)[O-]

InChI

InChI=1S/C10H12N2O4S/c13-10(11-5-6-17)16-7-8-1-3-9(4-2-8)12(14)15/h1-4,17H,5-7H2,(H,11,13)