(6-chloranyl-2-oxidanylidene-4-phenyl-chromen-7-yl) 3-(1H-indol-3-yl)-2-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: (6-chloranyl-2-oxidanylidene-4-phenyl-chromen-7-yl) 3-(1H-indol-3-yl)-2-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: (6-chloro-2-oxo-4-phenyl-chromen-7-yl) 3-(1H-indol-3-yl)-2-(p-tolylsulfonylamino)propanoate CAS Name: 3-(1H-indol-3-yl)-2-[(4-methylphenyl)sulfonylamino]propanoic acid (6-chloro-2-oxo-4-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (6-chloro-2-oxo-4-phenylchromen-7-yl) 3-(1H-indol-3-yl)-2-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-(1H-indol-3-yl)-2-(tosylamino)propionic acid (6-chloro-2-keto-4-phenyl-chromen-7-yl) ester Formula: C33H25ClN2O6S MolecularWeight: 613.0794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC4=C(C=C5C(=CC(=O)OC5=C4)C6=CC=CC=C6)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC4=C(C=C5C(=CC(=O)OC5=C4)C6=CC=CC=C6)Cl

InChI

InChI=1S/C33H25ClN2O6S/c1-20-11-13-23(14-12-20)43(39,40)36-29(15-22-19-35-28-10-6-5-9-24(22)28)33(38)42-31-18-30-26(16-27(31)34)25(17-32(37)41-30)21-7-3-2-4-8-21/h2-14,16-19,29,35-36H,15H2,1H3