(3-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]-2-phenyl-ethanoate

Systemtic Name: (3-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]-2-phenyl-ethanoate Openeye Name: (3-chloro-4-methyl-2-oxo-chromen-7-yl) 2-phenyl-2-(p-tolylsulfonylamino)acetate CAS Name: 2-[(4-methylphenyl)sulfonylamino]-2-phenylacetic acid (3-chloro-4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (3-chloro-4-methyl-2-oxochromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]-2-phenylacetate Traditional Name: 2-phenyl-2-(tosylamino)acetic acid (3-chloro-2-keto-4-methyl-chromen-7-yl) ester Formula: C25H20ClNO6S MolecularWeight: 497.9474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=CC=C2)C(=O)OC3=CC4=C(C=C3)C(=C(C(=O)O4)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=CC=C2)C(=O)OC3=CC4=C(C=C3)C(=C(C(=O)O4)Cl)C

InChI

InChI=1S/C25H20ClNO6S/c1-15-8-11-19(12-9-15)34(30,31)27-23(17-6-4-3-5-7-17)25(29)32-18-10-13-20-16(2)22(26)24(28)33-21(20)14-18/h3-14,23,27H,1-2H3