[4-[3-[8-cyclopentyl-2,6-bis(oxidanylidene)-1-propyl-7H-purin-3-yl]propyl]phenyl] ethanoate

Systemtic Name: [4-[3-[8-cyclopentyl-2,6-bis(oxidanylidene)-1-propyl-7H-purin-3-yl]propyl]phenyl] ethanoate Openeye Name: [4-[3-(8-cyclopentyl-2,6-dioxo-1-propyl-7H-purin-3-yl)propyl]phenyl] acetate CAS Name: acetic acid [4-[3-(8-cyclopentyl-2,6-dioxo-1-propyl-7H-purin-3-yl)propyl]phenyl] ester IUPAC Name: [4-[3-(8-cyclopentyl-2,6-dioxo-1-propyl-7H-purin-3-yl)propyl]phenyl] acetate Traditional Name: acetic acid [4-[3-(8-cyclopentyl-2,6-diketo-1-propyl-7H-purin-3-yl)propyl]phenyl] ester Formula: C24H30N4O4 MolecularWeight: 438.5194

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C(N2)C3CCCC3)N(C1=O)CCCC4=CC=C(C=C4)OC(=O)C

Isomeric SMILES

CCCN1C(=O)C2=C(N=C(N2)C3CCCC3)N(C1=O)CCCC4=CC=C(C=C4)OC(=O)C

InChI

InChI=1S/C24H30N4O4/c1-3-14-28-23(30)20-22(26-21(25-20)18-8-4-5-9-18)27(24(28)31)15-6-7-17-10-12-19(13-11-17)32-16(2)29/h10-13,18H,3-9,14-15H2,1-2H3,(H,25,26)