11-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]undecan-2-olate

Systemtic Name: 11-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]undecan-2-olate Openeye Name: 11-(3,7-dimethyl-2,6-dioxo-purin-1-yl)undecan-2-olate CAS Name: 11-(3,7-dimethyl-2,6-dioxo-1-purinyl)-2-undecanolate IUPAC Name: 11-(3,7-dimethyl-2,6-dioxopurin-1-yl)undecan-2-olate Traditional Name: 11-(2,6-diketo-3,7-dimethyl-purin-1-yl)undecan-2-olate Formula: C18H29N4O3- MolecularWeight: 349.44786

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C)[O-]

Isomeric SMILES

CC(CCCCCCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C)[O-]

InChI

InChI=1S/C18H29N4O3/c1-14(23)11-9-7-5-4-6-8-10-12-22-17(24)15-16(19-13-20(15)2)21(3)18(22)25/h13-14H,4-12H2,1-3H3/q-1