diethyl 5-phenyl-6-(7H-purin-6-yl)-1,3-dihydroindene-2,2-dicarboxylate

Systemtic Name: diethyl 5-phenyl-6-(7H-purin-6-yl)-1,3-dihydroindene-2,2-dicarboxylate Openeye Name: diethyl 5-phenyl-6-(7H-purin-6-yl)indane-2,2-dicarboxylate CAS Name: 5-phenyl-6-(7H-purin-6-yl)-1,3-dihydroindene-2,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-phenyl-6-(7H-purin-6-yl)-1,3-dihydroindene-2,2-dicarboxylate Traditional Name: 5-phenyl-6-(7H-purin-6-yl)indane-2,2-dicarboxylic acid diethyl ester Formula: C26H24N4O4 MolecularWeight: 456.49316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC2=C(C1)C=C(C(=C2)C3=CC=CC=C3)C4=C5C(=NC=N4)N=CN5)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CC2=C(C1)C=C(C(=C2)C3=CC=CC=C3)C4=C5C(=NC=N4)N=CN5)C(=O)OCC

InChI

InChI=1S/C26H24N4O4/c1-3-33-24(31)26(25(32)34-4-2)12-17-10-19(16-8-6-5-7-9-16)20(11-18(17)13-26)21-22-23(29-14-27-21)30-15-28-22/h5-11,14-15H,3-4,12-13H2,1-2H3,(H,27,28,29,30)