[(1R,2R)-1-(4-chlorophenyl)-2-nitro-2-phenylsulfanyl-ethyl] ethanoate

Systemtic Name: [(1R,2R)-1-(4-chlorophenyl)-2-nitro-2-phenylsulfanyl-ethyl] ethanoate Openeye Name: [(1R,2R)-1-(4-chlorophenyl)-2-nitro-2-phenylsulfanyl-ethyl] acetate CAS Name: acetic acid [(1R,2R)-1-(4-chlorophenyl)-2-nitro-2-(phenylthio)ethyl] ester IUPAC Name: [(1R,2R)-1-(4-chlorophenyl)-2-nitro-2-phenylsulfanylethyl] acetate Traditional Name: acetic acid [(1R,2R)-1-(4-chlorophenyl)-2-nitro-2-(phenylthio)ethyl] ester Formula: C16H14ClNO4S MolecularWeight: 351.80466

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CC=C(C=C1)Cl)C([N+](=O)[O-])SC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClNO4S/c1-11(19)22-15(12-7-9-13(17)10-8-12)16(18(20)21)23-14-5-3-2-4-6-14/h2-10,15-16H,1H3/t15-,16-/m1/s1