5-[[4-[phenylsulfonyl(propan-2-yl)amino]phenoxy]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[4-[phenylsulfonyl(propan-2-yl)amino]phenoxy]methyl]furan-2-carboxylic acid Openeye Name: 5-[[4-[benzenesulfonyl(isopropyl)amino]phenoxy]methyl]furan-2-carboxylic acid CAS Name: 5-[[4-[benzenesulfonyl(propan-2-yl)amino]phenoxy]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[4-[benzenesulfonyl(propan-2-yl)amino]phenoxy]methyl]furan-2-carboxylic acid Traditional Name: 5-[[4-[besyl(isopropyl)amino]phenoxy]methyl]-2-furoic acid Formula: C21H21NO6S MolecularWeight: 415.45954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)N(C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H21NO6S/c1-15(2)22(29(25,26)19-6-4-3-5-7-19)16-8-10-17(11-9-16)27-14-18-12-13-20(28-18)21(23)24/h3-13,15H,14H2,1-2H3,(H,23,24)