2-[5-[2-[4-[2-[2,4,6-tris(oxidanyl)phenyl]ethanoylamino]phenyl]phenyl]thiophen-2-yl]ethanoic acid

Systemtic Name: 2-[5-[2-[4-[2-[2,4,6-tris(oxidanyl)phenyl]ethanoylamino]phenyl]phenyl]thiophen-2-yl]ethanoic acid Openeye Name: 2-[5-[2-[4-[[2-(2,4,6-trihydroxyphenyl)acetyl]amino]phenyl]phenyl]-2-thienyl]acetic acid CAS Name: 2-[5-[2-[4-[[1-oxo-2-(2,4,6-trihydroxyphenyl)ethyl]amino]phenyl]phenyl]-2-thiophenyl]acetic acid IUPAC Name: 2-[5-[2-[4-[[2-(2,4,6-trihydroxyphenyl)acetyl]amino]phenyl]phenyl]thiophen-2-yl]acetic acid Traditional Name: 2-[5-[2-[4-[[2-(2,4,6-trihydroxyphenyl)acetyl]amino]phenyl]phenyl]-2-thienyl]acetic acid Formula: C26H21NO6S MolecularWeight: 475.51304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)NC(=O)CC3=C(C=C(C=C3O)O)O)C4=CC=C(S4)CC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)NC(=O)CC3=C(C=C(C=C3O)O)O)C4=CC=C(S4)CC(=O)O

InChI

InChI=1S/C26H21NO6S/c28-17-11-22(29)21(23(30)12-17)14-25(31)27-16-7-5-15(6-8-16)19-3-1-2-4-20(19)24-10-9-18(34-24)13-26(32)33/h1-12,28-30H,13-14H2,(H,27,31)(H,32,33)