2-[3-[[phenylsulfonyl-[(4-pyridin-4-ylphenyl)methyl]amino]methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[3-[[phenylsulfonyl-[(4-pyridin-4-ylphenyl)methyl]amino]methyl]phenoxy]ethanoic acid Openeye Name: 2-[3-[[benzenesulfonyl-[[4-(4-pyridyl)phenyl]methyl]amino]methyl]phenoxy]acetic acid CAS Name: 2-[3-[[benzenesulfonyl-[(4-pyridin-4-ylphenyl)methyl]amino]methyl]phenoxy]acetic acid IUPAC Name: 2-[3-[[benzenesulfonyl-[(4-pyridin-4-ylphenyl)methyl]amino]methyl]phenoxy]acetic acid Traditional Name: 2-[3-[[besyl-[4-(4-pyridyl)benzyl]amino]methyl]phenoxy]acetic acid Formula: C27H24N2O5S MolecularWeight: 488.55486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C3=CC=NC=C3)CC4=CC(=CC=C4)OCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C3=CC=NC=C3)CC4=CC(=CC=C4)OCC(=O)O

InChI

InChI=1S/C27H24N2O5S/c30-27(31)20-34-25-6-4-5-22(17-25)19-29(35(32,33)26-7-2-1-3-8-26)18-21-9-11-23(12-10-21)24-13-15-28-16-14-24/h1-17H,18-20H2,(H,30,31)