(4-nitrophenyl)methyl 3-sulfanylpropanoate

Systemtic Name: (4-nitrophenyl)methyl 3-sulfanylpropanoate Openeye Name: (4-nitrophenyl)methyl 3-sulfanylpropanoate CAS Name: 3-mercaptopropanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-sulfanylpropanoate Traditional Name: 3-mercaptopropionic acid (4-nitrobenzyl) ester Formula: C10H11NO4S MolecularWeight: 241.26364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO4S/c12-10(5-6-16)15-7-8-1-3-9(4-2-8)11(13)14/h1-4,16H,5-7H2