2-[[4-[2-[(2-methyl-5-phenyl-furan-3-yl)carbonylamino]ethyl]phenoxy]methyl]benzoic acid

Systemtic Name: 2-[[4-[2-[(2-methyl-5-phenyl-furan-3-yl)carbonylamino]ethyl]phenoxy]methyl]benzoic acid Openeye Name: 2-[[4-[2-[(2-methyl-5-phenyl-furan-3-carbonyl)amino]ethyl]phenoxy]methyl]benzoic acid CAS Name: 2-[[4-[2-[[(2-methyl-5-phenyl-3-furanyl)-oxomethyl]amino]ethyl]phenoxy]methyl]benzoic acid IUPAC Name: 2-[[4-[2-[(2-methyl-5-phenylfuran-3-carbonyl)amino]ethyl]phenoxy]methyl]benzoic acid Traditional Name: 2-[[4-[2-[(2-methyl-5-phenyl-3-furoyl)amino]ethyl]phenoxy]methyl]benzoic acid Formula: C28H25NO5 MolecularWeight: 455.5018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C2=CC=CC=C2)C(=O)NCCC3=CC=C(C=C3)OCC4=CC=CC=C4C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)C2=CC=CC=C2)C(=O)NCCC3=CC=C(C=C3)OCC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C28H25NO5/c1-19-25(17-26(34-19)21-7-3-2-4-8-21)27(30)29-16-15-20-11-13-23(14-12-20)33-18-22-9-5-6-10-24(22)28(31)32/h2-14,17H,15-16,18H2,1H3,(H,29,30)(H,31,32)