methyl 3-[2,6-bis(oxidanylidene)-1,3-dipropyl-7H-purin-8-yl]propanoate

Systemtic Name: methyl 3-[2,6-bis(oxidanylidene)-1,3-dipropyl-7H-purin-8-yl]propanoate Openeye Name: methyl 3-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)propanoate CAS Name: 3-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)propanoate Traditional Name: 3-(2,6-diketo-1,3-dipropyl-7H-purin-8-yl)propionic acid methyl ester Formula: C15H22N4O4 MolecularWeight: 322.35958

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)CCC(=O)OC

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)CCC(=O)OC

InChI

InChI=1S/C15H22N4O4/c1-4-8-18-13-12(14(21)19(9-5-2)15(18)22)16-10(17-13)6-7-11(20)23-3/h4-9H2,1-3H3,(H,16,17)