[3-butyl-2,6-bis(oxidanylidene)-7-propyl-purin-8-yl]methyl 2-(2,3-dihydro-1H-inden-5-yloxy)propanoate

Systemtic Name: [3-butyl-2,6-bis(oxidanylidene)-7-propyl-purin-8-yl]methyl 2-(2,3-dihydro-1H-inden-5-yloxy)propanoate Openeye Name: (3-butyl-2,6-dioxo-7-propyl-purin-8-yl)methyl 2-indan-5-yloxypropanoate CAS Name: 2-(2,3-dihydro-1H-inden-5-yloxy)propanoic acid (3-butyl-2,6-dioxo-7-propyl-8-purinyl)methyl ester IUPAC Name: (3-butyl-2,6-dioxo-7-propylpurin-8-yl)methyl 2-(2,3-dihydro-1H-inden-5-yloxy)propanoate Traditional Name: 2-indan-5-yloxypropionic acid (3-butyl-2,6-diketo-7-propyl-purin-8-yl)methyl ester Formula: C25H32N4O5 MolecularWeight: 468.54538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)COC(=O)C(C)OC3=CC4=C(CCC4)C=C3)CCC

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)COC(=O)C(C)OC3=CC4=C(CCC4)C=C3)CCC

InChI

InChI=1S/C25H32N4O5/c1-4-6-13-29-22-21(23(30)27-25(29)32)28(12-5-2)20(26-22)15-33-24(31)16(3)34-19-11-10-17-8-7-9-18(17)14-19/h10-11,14,16H,4-9,12-13,15H2,1-3H3,(H,27,30,32)