15-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]pentadecan-2-olate

Systemtic Name: 15-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]pentadecan-2-olate Openeye Name: 15-(1,3-dimethyl-2,6-dioxo-purin-7-yl)pentadecan-2-olate CAS Name: 15-(1,3-dimethyl-2,6-dioxo-7-purinyl)-2-pentadecanolate IUPAC Name: 15-(1,3-dimethyl-2,6-dioxopurin-7-yl)pentadecan-2-olate Traditional Name: 15-(2,6-diketo-1,3-dimethyl-purin-7-yl)pentadecan-2-olate Formula: C22H37N4O3- MolecularWeight: 405.55418

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCCCCCCCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)[O-]

Isomeric SMILES

CC(CCCCCCCCCCCCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)[O-]

InChI

InChI=1S/C22H37N4O3/c1-18(27)15-13-11-9-7-5-4-6-8-10-12-14-16-26-17-23-20-19(26)21(28)25(3)22(29)24(20)2/h17-18H,4-16H2,1-3H3/q-1