(4-ethyl-7-methyl-2-oxidanylidene-chromen-5-yl) 2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoate

Systemtic Name: (4-ethyl-7-methyl-2-oxidanylidene-chromen-5-yl) 2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoate Openeye Name: (4-ethyl-7-methyl-2-oxo-chromen-5-yl) 3-phenyl-2-(p-tolylsulfonylamino)propanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid (4-ethyl-7-methyl-2-oxo-1-benzopyran-5-yl) ester IUPAC Name: (4-ethyl-7-methyl-2-oxochromen-5-yl) 2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: 3-phenyl-2-(tosylamino)propionic acid (4-ethyl-2-keto-7-methyl-chromen-5-yl) ester Formula: C28H27NO6S MolecularWeight: 505.58208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)C(CC3=CC=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)C(CC3=CC=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C28H27NO6S/c1-4-21-17-26(30)34-24-14-19(3)15-25(27(21)24)35-28(31)23(16-20-8-6-5-7-9-20)29-36(32,33)22-12-10-18(2)11-13-22/h5-15,17,23,29H,4,16H2,1-3H3