(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenoxy]ethanoate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenoxy]ethanoate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 2-[4-[methyl(p-tolylsulfonyl)amino]phenoxy]acetate CAS Name: 2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]acetic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]acetate Traditional Name: 2-[4-[methyl(tosyl)amino]phenoxy]acetic acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C28H26N2O8S MolecularWeight: 550.57964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)NC(=O)C

InChI

InChI=1S/C28H26N2O8S/c1-18-4-11-24(12-5-18)39(34,35)30(3)22-7-9-23(10-8-22)36-17-28(33)37-16-20-14-27(32)38-26-15-21(29-19(2)31)6-13-25(20)26/h4-15H,16-17H2,1-3H3,(H,29,31)