3-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]propyl 2,4-dimethoxybenzoate

Systemtic Name: 3-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]propyl 2,4-dimethoxybenzoate Openeye Name: 3-(3,7-dimethyl-2,6-dioxo-purin-1-yl)propyl 2,4-dimethoxybenzoate CAS Name: 2,4-dimethoxybenzoic acid 3-(3,7-dimethyl-2,6-dioxo-1-purinyl)propyl ester IUPAC Name: 3-(3,7-dimethyl-2,6-dioxopurin-1-yl)propyl 2,4-dimethoxybenzoate Traditional Name: 2,4-dimethoxybenzoic acid 3-(2,6-diketo-3,7-dimethyl-purin-1-yl)propyl ester Formula: C19H22N4O6 MolecularWeight: 402.40118

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCOC(=O)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCOC(=O)C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C19H22N4O6/c1-21-11-20-16-15(21)17(24)23(19(26)22(16)2)8-5-9-29-18(25)13-7-6-12(27-3)10-14(13)28-4/h6-7,10-11H,5,8-9H2,1-4H3