[3-butyl-2,6-bis(oxidanylidene)-7-propyl-purin-8-yl]methyl 2-naphthalen-2-yloxyethanoate

Systemtic Name: [3-butyl-2,6-bis(oxidanylidene)-7-propyl-purin-8-yl]methyl 2-naphthalen-2-yloxyethanoate Openeye Name: (3-butyl-2,6-dioxo-7-propyl-purin-8-yl)methyl 2-(2-naphthyloxy)acetate CAS Name: 2-(2-naphthalenyloxy)acetic 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-naphthalen-2-yloxyacetate Traditional Name: 2-(2-naphthoxy)acetic acid (3-butyl-2,6-diketo-7-propyl-purin-8-yl)methyl ester Formula: C25H28N4O5 MolecularWeight: 464.51362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)COC(=O)COC3=CC4=CC=CC=C4C=C3)CCC

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)COC(=O)COC3=CC4=CC=CC=C4C=C3)CCC

InChI

InChI=1S/C25H28N4O5/c1-3-5-13-29-23-22(24(31)27-25(29)32)28(12-4-2)20(26-23)15-34-21(30)16-33-19-11-10-17-8-6-7-9-18(17)14-19/h6-11,14H,3-5,12-13,15-16H2,1-2H3,(H,27,31,32)