2-ethoxy-3-[4-[2-[4-(4-nitrophenyl)sulfonyloxyphenyl]ethoxy]phenyl]propanoic acid

Systemtic Name: 2-ethoxy-3-[4-[2-[4-(4-nitrophenyl)sulfonyloxyphenyl]ethoxy]phenyl]propanoic acid Openeye Name: 2-ethoxy-3-[4-[2-[4-(4-nitrophenyl)sulfonyloxyphenyl]ethoxy]phenyl]propanoic acid CAS Name: 2-ethoxy-3-[4-[2-[4-(4-nitrophenyl)sulfonyloxyphenyl]ethoxy]phenyl]propanoic acid IUPAC Name: 2-ethoxy-3-[4-[2-[4-(4-nitrophenyl)sulfonyloxyphenyl]ethoxy]phenyl]propanoic acid Traditional Name: 2-ethoxy-3-[4-[2-(4-nosyloxyphenyl)ethoxy]phenyl]propionic acid Formula: C25H25NO9S MolecularWeight: 515.5323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCCC2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OCCC2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C25H25NO9S/c1-2-33-24(25(27)28)17-19-5-9-21(10-6-19)34-16-15-18-3-11-22(12-4-18)35-36(31,32)23-13-7-20(8-14-23)26(29)30/h3-14,24H,2,15-17H2,1H3,(H,27,28)