2-[4-(2-ethoxy-5-methyl-3-nitro-phenyl)-1,3-thiazol-2-yl]ethanoic acid

Systemtic Name: 2-[4-(2-ethoxy-5-methyl-3-nitro-phenyl)-1,3-thiazol-2-yl]ethanoic acid Openeye Name: 2-[4-(2-ethoxy-5-methyl-3-nitro-phenyl)thiazol-2-yl]acetic acid CAS Name: 2-[4-(2-ethoxy-5-methyl-3-nitrophenyl)-2-thiazolyl]acetic acid IUPAC Name: 2-[4-(2-ethoxy-5-methyl-3-nitrophenyl)-1,3-thiazol-2-yl]acetic acid Traditional Name: 2-[4-(2-ethoxy-5-methyl-3-nitro-phenyl)thiazol-2-yl]acetic acid Formula: C14H14N2O5S MolecularWeight: 322.33636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1C2=CSC(=N2)CC(=O)O)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1C2=CSC(=N2)CC(=O)O)C)[N+](=O)[O-]

InChI

InChI=1S/C14H14N2O5S/c1-3-21-14-9(4-8(2)5-11(14)16(19)20)10-7-22-12(15-10)6-13(17)18/h4-5,7H,3,6H2,1-2H3,(H,17,18)