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

Systemtic Name: 15-[7-[2-(dimethylamino)hexyl]-3-methyl-2,6-bis(oxidanylidene)purin-1-yl]pentadecan-2-olate Openeye Name: 15-[7-[2-(dimethylamino)hexyl]-3-methyl-2,6-dioxo-purin-1-yl]pentadecan-2-olate CAS Name: 15-[7-[2-(dimethylamino)hexyl]-3-methyl-2,6-dioxo-1-purinyl]-2-pentadecanolate IUPAC Name: 15-[7-[2-(dimethylamino)hexyl]-3-methyl-2,6-dioxopurin-1-yl]pentadecan-2-olate Traditional Name: 15-[7-[2-(dimethylamino)hexyl]-2,6-diketo-3-methyl-purin-1-yl]pentadecan-2-olate Formula: C29H52N5O3- MolecularWeight: 518.75488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCCCCCCCC(C)[O-])N(C)C

Isomeric SMILES

CCCCC(CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCCCCCCCC(C)[O-])N(C)C

InChI

InChI=1S/C29H52N5O3/c1-6-7-20-25(31(3)4)22-33-23-30-27-26(33)28(36)34(29(37)32(27)5)21-18-16-14-12-10-8-9-11-13-15-17-19-24(2)35/h23-25H,6-22H2,1-5H3/q-1