2,3-bis[(2-nitro-1-phenyl-ethyl)sulfanyl]propan-1-ol

Systemtic Name: 2,3-bis[(2-nitro-1-phenyl-ethyl)sulfanyl]propan-1-ol Openeye Name: 2,3-bis[(2-nitro-1-phenyl-ethyl)sulfanyl]propan-1-ol CAS Name: 2,3-bis[(2-nitro-1-phenylethyl)thio]-1-propanol IUPAC Name: 2,3-bis[(2-nitro-1-phenylethyl)sulfanyl]propan-1-ol Traditional Name: 2,3-bis[(2-nitro-1-phenyl-ethyl)thio]propan-1-ol Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C[N+](=O)[O-])SCC(CO)SC(C[N+](=O)[O-])C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(C[N+](=O)[O-])SCC(CO)SC(C[N+](=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C19H22N2O5S2/c22-13-17(28-19(12-21(25)26)16-9-5-2-6-10-16)14-27-18(11-20(23)24)15-7-3-1-4-8-15/h1-10,17-19,22H,11-14H2