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

Systemtic Name: (8-methyl-2-oxidanylidene-4-phenyl-chromen-7-yl) 3-(1H-indol-3-yl)-2-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: (8-methyl-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 (8-methyl-2-oxo-4-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (8-methyl-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 (2-keto-8-methyl-4-phenyl-chromen-7-yl) ester Formula: C34H28N2O6S MolecularWeight: 592.66092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC4=C(C5=C(C=C4)C(=CC(=O)O5)C6=CC=CC=C6)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC4=C(C5=C(C=C4)C(=CC(=O)O5)C6=CC=CC=C6)C

InChI

InChI=1S/C34H28N2O6S/c1-21-12-14-25(15-13-21)43(39,40)36-30(18-24-20-35-29-11-7-6-10-26(24)29)34(38)41-31-17-16-27-28(23-8-4-3-5-9-23)19-32(37)42-33(27)22(31)2/h3-17,19-20,30,35-36H,18H2,1-2H3