2-[2-(4-fluoranyl-2-methyl-phenyl)-4-methyl-1,3-thiazol-5-yl]ethyl nitrate

Systemtic Name: 2-[2-(4-fluoranyl-2-methyl-phenyl)-4-methyl-1,3-thiazol-5-yl]ethyl nitrate Openeye Name: 2-[2-(4-fluoro-2-methyl-phenyl)-4-methyl-thiazol-5-yl]ethyl nitrate CAS Name: nitric acid 2-[2-(4-fluoro-2-methylphenyl)-4-methyl-5-thiazolyl]ethyl ester IUPAC Name: 2-[2-(4-fluoro-2-methylphenyl)-4-methyl-1,3-thiazol-5-yl]ethyl nitrate Traditional Name: nitric acid 2-[2-(4-fluoro-2-methyl-phenyl)-4-methyl-thiazol-5-yl]ethyl ester Formula: C13H13FN2O3S MolecularWeight: 296.317323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)C2=NC(=C(S2)CCO[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=CC(=C1)F)C2=NC(=C(S2)CCO[N+](=O)[O-])C

InChI

InChI=1S/C13H13FN2O3S/c1-8-7-10(14)3-4-11(8)13-15-9(2)12(20-13)5-6-19-16(17)18/h3-4,7H,5-6H2,1-2H3