4-[[4,5-dimethyl-2-[(5-methylfuran-2-yl)sulfonyl-propan-2-yl-amino]phenoxy]methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[[4,5-dimethyl-2-[(5-methylfuran-2-yl)sulfonyl-propan-2-yl-amino]phenoxy]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[[2-[isopropyl-[(5-methyl-2-furyl)sulfonyl]amino]-4,5-dimethyl-phenoxy]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[4,5-dimethyl-2-[(5-methyl-2-furanyl)sulfonyl-propan-2-ylamino]phenoxy]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[4,5-dimethyl-2-[(5-methylfuran-2-yl)sulfonyl-propan-2-ylamino]phenoxy]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[2-[isopropyl-[(5-methyl-2-furyl)sulfonyl]amino]-4,5-dimethyl-phenoxy]methyl]-3-methoxy-benzoic acid Formula: C25H29NO7S MolecularWeight: 487.56526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29NO7S/c1-15(2)26(34(29,30)24-10-7-18(5)33-24)21-11-16(3)17(4)12-23(21)32-14-20-9-8-19(25(27)28)13-22(20)31-6/h7-13,15H,14H2,1-6H3,(H,27,28)