(E)-3-[4-methoxy-3-[2-(4-methoxyphenyl)-4-nitro-phenoxy]sulfonyl-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-methoxy-3-[2-(4-methoxyphenyl)-4-nitro-phenoxy]sulfonyl-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-methoxy-3-[2-(4-methoxyphenyl)-4-nitro-phenoxy]sulfonyl-phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-methoxy-3-[2-(4-methoxyphenyl)-4-nitrophenoxy]sulfonylphenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-methoxy-3-[2-(4-methoxyphenyl)-4-nitrophenoxy]sulfonylphenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-methoxy-3-[2-(4-methoxyphenyl)-4-nitro-phenoxy]sulfonyl-phenyl]acrylic acid Formula: C23H19NO9S MolecularWeight: 485.46326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19NO9S/c1-31-18-8-5-16(6-9-18)19-14-17(24(27)28)7-11-20(19)33-34(29,30)22-13-15(4-12-23(25)26)3-10-21(22)32-2/h3-14H,1-2H3,(H,25,26)/b12-4+