2-(5,5-dimethyl-3-octadecyl-1,3-thiazolidin-2-yl)-4-nitro-phenol

Systemtic Name: 2-(5,5-dimethyl-3-octadecyl-1,3-thiazolidin-2-yl)-4-nitro-phenol Openeye Name: 2-(5,5-dimethyl-3-octadecyl-thiazolidin-2-yl)-4-nitro-phenol CAS Name: 2-(5,5-dimethyl-3-octadecyl-2-thiazolidinyl)-4-nitrophenol IUPAC Name: 2-(5,5-dimethyl-3-octadecyl-1,3-thiazolidin-2-yl)-4-nitrophenol Traditional Name: 2-(5,5-dimethyl-3-stearyl-thiazolidin-2-yl)-4-nitro-phenol Formula: C29H50N2O3S MolecularWeight: 506.7839

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN1CC(SC1C2=C(C=CC(=C2)[N+](=O)[O-])O)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN1CC(SC1C2=C(C=CC(=C2)[N+](=O)[O-])O)(C)C

InChI

InChI=1S/C29H50N2O3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-30-24-29(2,3)35-28(30)26-23-25(31(33)34)20-21-27(26)32/h20-21,23,28,32H,4-19,22,24H2,1-3H3