2-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)sulfanylethanol

Systemtic Name: 2-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)sulfanylethanol Openeye Name: 2-(4-morpholinosulfonyl-2-nitro-phenyl)sulfanylethanol CAS Name: 2-[[4-(4-morpholinylsulfonyl)-2-nitrophenyl]thio]ethanol IUPAC Name: 2-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)sulfanylethanol Traditional Name: 2-[(4-morpholinosulfonyl-2-nitro-phenyl)thio]ethanol Formula: C12H16N2O6S2 MolecularWeight: 348.39524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)SCCO)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)SCCO)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O6S2/c15-5-8-21-12-2-1-10(9-11(12)14(16)17)22(18,19)13-3-6-20-7-4-13/h1-2,9,15H,3-8H2