methyl (2R)-4-[2-(4-nitrophenyl)sulfanylethanoyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[2-(4-nitrophenyl)sulfanylethanoyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[2-(4-nitrophenyl)sulfanylacetyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[2-[(4-nitrophenyl)thio]-1-oxoethyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[2-(4-nitrophenyl)sulfanylacetyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[2-[(4-nitrophenyl)thio]acetyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C14H16N2O5S2 MolecularWeight: 356.41724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCS1)C(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)[C@H]1CN(CCS1)C(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O5S2/c1-21-14(18)12-8-15(6-7-22-12)13(17)9-23-11-4-2-10(3-5-11)16(19)20/h2-5,12H,6-9H2,1H3/t12-/m1/s1