(6-oxidanylidenebenzo[c]chromen-3-yl) 3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate

Systemtic Name: (6-oxidanylidenebenzo[c]chromen-3-yl) 3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate Openeye Name: (6-oxobenzo[c]chromen-3-yl) 3-methyl-2-(p-tolylsulfonylamino)butanoate CAS Name: 3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoic acid (6-oxo-3-benzo[c][1]benzopyranyl) ester IUPAC Name: (6-oxobenzo[c]chromen-3-yl) 3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate Traditional Name: 3-methyl-2-(tosylamino)butyric acid (6-ketobenzo[c]chromen-3-yl) ester Formula: C25H23NO6S MolecularWeight: 465.51822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)OC2=CC3=C(C=C2)C4=CC=CC=C4C(=O)O3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)OC2=CC3=C(C=C2)C4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C25H23NO6S/c1-15(2)23(26-33(29,30)18-11-8-16(3)9-12-18)25(28)31-17-10-13-20-19-6-4-5-7-21(19)24(27)32-22(20)14-17/h4-15,23,26H,1-3H3