(4-methylsulfanylphenyl)methyl (2R)-2-(4-nitrophenyl)sulfanylpropanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl (2R)-2-(4-nitrophenyl)sulfanylpropanoate Openeye Name: (4-methylsulfanylphenyl)methyl (2R)-2-(4-nitrophenyl)sulfanylpropanoate CAS Name: (2R)-2-[(4-nitrophenyl)thio]propanoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl (2R)-2-(4-nitrophenyl)sulfanylpropanoate Traditional Name: (2R)-2-[(4-nitrophenyl)thio]propionic acid [4-(methylthio)benzyl] ester Formula: C17H17NO4S2 MolecularWeight: 363.45118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=C(C=C1)SC)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)OCC1=CC=C(C=C1)SC)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H17NO4S2/c1-12(24-16-9-5-14(6-10-16)18(20)21)17(19)22-11-13-3-7-15(23-2)8-4-13/h3-10,12H,11H2,1-2H3/t12-/m1/s1