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

Systemtic Name: 4-[[4,5-dimethyl-2-[(5-methylfuran-2-yl)sulfonyl-propan-2-yl-amino]phenoxy]methyl]benzoic acid Openeye Name: 4-[[2-[isopropyl-[(5-methyl-2-furyl)sulfonyl]amino]-4,5-dimethyl-phenoxy]methyl]benzoic acid CAS Name: 4-[[4,5-dimethyl-2-[(5-methyl-2-furanyl)sulfonyl-propan-2-ylamino]phenoxy]methyl]benzoic acid IUPAC Name: 4-[[4,5-dimethyl-2-[(5-methylfuran-2-yl)sulfonyl-propan-2-ylamino]phenoxy]methyl]benzoic acid Traditional Name: 4-[[2-[isopropyl-[(5-methyl-2-furyl)sulfonyl]amino]-4,5-dimethyl-phenoxy]methyl]benzoic acid Formula: C24H27NO6S MolecularWeight: 457.53928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)S(=O)(=O)N(C2=C(C=C(C(=C2)C)C)OCC3=CC=C(C=C3)C(=O)O)C(C)C

Isomeric SMILES

CC1=CC=C(O1)S(=O)(=O)N(C2=C(C=C(C(=C2)C)C)OCC3=CC=C(C=C3)C(=O)O)C(C)C

InChI

InChI=1S/C24H27NO6S/c1-15(2)25(32(28,29)23-11-6-18(5)31-23)21-12-16(3)17(4)13-22(21)30-14-19-7-9-20(10-8-19)24(26)27/h6-13,15H,14H2,1-5H3,(H,26,27)