methyl 6-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoylamino]hexanoate

Systemtic Name: methyl 6-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoylamino]hexanoate Openeye Name: methyl 6-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]hexanoate CAS Name: 6-[[2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-1-oxoethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]amino]hexanoate Traditional Name: 6-[[2-(2,6-diketo-1,3-dimethyl-purin-7-yl)acetyl]amino]hexanoic acid methyl ester Formula: C16H23N5O5 MolecularWeight: 365.38432

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NCCCCCC(=O)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NCCCCCC(=O)OC

InChI

InChI=1S/C16H23N5O5/c1-19-14-13(15(24)20(2)16(19)25)21(10-18-14)9-11(22)17-8-6-4-5-7-12(23)26-3/h10H,4-9H2,1-3H3,(H,17,22)