S-[(1R)-2-nitro-1-phenyl-ethyl] ethanethioate

Systemtic Name: S-[(1R)-2-nitro-1-phenyl-ethyl] ethanethioate Openeye Name: S-[(1R)-2-nitro-1-phenyl-ethyl] ethanethioate CAS Name: ethanethioic acid S-[(1R)-2-nitro-1-phenylethyl] ester IUPAC Name: S-[(1R)-2-nitro-1-phenylethyl] ethanethioate Traditional Name: ethanethioic acid S-[(1R)-2-nitro-1-phenyl-ethyl] ester Formula: C10H11NO3S MolecularWeight: 225.26424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)S[C@@H](C[N+](=O)[O-])C1=CC=CC=C1

InChI

InChI=1S/C10H11NO3S/c1-8(12)15-10(7-11(13)14)9-5-3-2-4-6-9/h2-6,10H,7H2,1H3/t10-/m0/s1