4-[[2-[ethyl-(5-methylfuran-2-yl)sulfonyl-amino]-4,5-dimethyl-phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[2-[ethyl-(5-methylfuran-2-yl)sulfonyl-amino]-4,5-dimethyl-phenoxy]methyl]benzoic acid Openeye Name: 4-[[2-[ethyl-[(5-methyl-2-furyl)sulfonyl]amino]-4,5-dimethyl-phenoxy]methyl]benzoic acid CAS Name: 4-[[2-[ethyl-[(5-methyl-2-furanyl)sulfonyl]amino]-4,5-dimethylphenoxy]methyl]benzoic acid IUPAC Name: 4-[[2-[ethyl-(5-methylfuran-2-yl)sulfonylamino]-4,5-dimethylphenoxy]methyl]benzoic acid Traditional Name: 4-[[2-[ethyl-[(5-methyl-2-furyl)sulfonyl]amino]-4,5-dimethyl-phenoxy]methyl]benzoic acid Formula: C23H25NO6S MolecularWeight: 443.5127

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=C(C(=C1)C)C)OCC2=CC=C(C=C2)C(=O)O)S(=O)(=O)C3=CC=C(O3)C

Isomeric SMILES

CCN(C1=C(C=C(C(=C1)C)C)OCC2=CC=C(C=C2)C(=O)O)S(=O)(=O)C3=CC=C(O3)C

InChI

InChI=1S/C23H25NO6S/c1-5-24(31(27,28)22-11-6-17(4)30-22)20-12-15(2)16(3)13-21(20)29-14-18-7-9-19(10-8-18)23(25)26/h6-13H,5,14H2,1-4H3,(H,25,26)