(4-nitrophenyl)methyl N-(3-sulfanylpropyl)carbamate

Systemtic Name: (4-nitrophenyl)methyl N-(3-sulfanylpropyl)carbamate Openeye Name: (4-nitrophenyl)methyl N-(3-sulfanylpropyl)carbamate CAS Name: N-(3-mercaptopropyl)carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-(3-sulfanylpropyl)carbamate Traditional Name: N-(3-mercaptopropyl)carbamic acid (4-nitrobenzyl) ester Formula: C11H14N2O4S MolecularWeight: 270.30486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O4S/c14-11(12-6-1-7-18)17-8-9-2-4-10(5-3-9)13(15)16/h2-5,18H,1,6-8H2,(H,12,14)