methyl 2-[6-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]hexan-2-yloxymethyl]prop-2-enoate

Systemtic Name: methyl 2-[6-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]hexan-2-yloxymethyl]prop-2-enoate Openeye Name: methyl 2-[[5-(3,7-dimethyl-2,6-dioxo-purin-1-yl)-1-methyl-pentoxy]methyl]prop-2-enoate CAS Name: 2-[6-(3,7-dimethyl-2,6-dioxo-1-purinyl)hexan-2-yloxymethyl]-2-propenoic acid methyl ester IUPAC Name: methyl 2-[6-(3,7-dimethyl-2,6-dioxopurin-1-yl)hexan-2-yloxymethyl]prop-2-enoate Traditional Name: 2-[[5-(2,6-diketo-3,7-dimethyl-purin-1-yl)-1-methyl-pentoxy]methyl]acrylic acid methyl ester Formula: C18H26N4O5 MolecularWeight: 378.42284

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C)OCC(=C)C(=O)OC

Isomeric SMILES

CC(CCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C)OCC(=C)C(=O)OC

InChI

InChI=1S/C18H26N4O5/c1-12(17(24)26-5)10-27-13(2)8-6-7-9-22-16(23)14-15(19-11-20(14)3)21(4)18(22)25/h11,13H,1,6-10H2,2-5H3