5-[2-(4-methoxyphenyl)-4-nitro-phenoxy]sulfonylthiophene-3-carboxylic acid

Systemtic Name: 5-[2-(4-methoxyphenyl)-4-nitro-phenoxy]sulfonylthiophene-3-carboxylic acid Openeye Name: 5-[2-(4-methoxyphenyl)-4-nitro-phenoxy]sulfonylthiophene-3-carboxylic acid CAS Name: 5-[2-(4-methoxyphenyl)-4-nitrophenoxy]sulfonyl-3-thiophenecarboxylic acid IUPAC Name: 5-[2-(4-methoxyphenyl)-4-nitrophenoxy]sulfonylthiophene-3-carboxylic acid Traditional Name: 5-[2-(4-methoxyphenyl)-4-nitro-phenoxy]sulfonyl-3-thenoic acid Formula: C18H13NO8S2 MolecularWeight: 435.42772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C=CC(=C2)[N+](=O)[O-])OS(=O)(=O)C3=CC(=CS3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C=CC(=C2)[N+](=O)[O-])OS(=O)(=O)C3=CC(=CS3)C(=O)O

InChI

InChI=1S/C18H13NO8S2/c1-26-14-5-2-11(3-6-14)15-9-13(19(22)23)4-7-16(15)27-29(24,25)17-8-12(10-28-17)18(20)21/h2-10H,1H3,(H,20,21)