[1-[5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]-2-oxidanylidene-heptadecyl] pyridine-3-carboxylate

Systemtic Name: [1-[5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]-2-oxidanylidene-heptadecyl] pyridine-3-carboxylate Openeye Name: [1-[3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]-2-oxo-heptadecyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [1-[3-hydroxy-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]-2-oxoheptadecyl] ester IUPAC Name: [1-[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]-2-oxoheptadecyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [1-[5-(2,4-diketo-5-methyl-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]-2-keto-heptadecyl] ester Formula: C32H47N3O7 MolecularWeight: 585.73148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(C1C(CC(O1)N2C=C(C(=O)NC2=O)C)O)OC(=O)C3=CN=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(C1C(CC(O1)N2C=C(C(=O)NC2=O)C)O)OC(=O)C3=CN=CC=C3

InChI

InChI=1S/C32H47N3O7/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-25(36)28(42-31(39)24-17-16-19-33-21-24)29-26(37)20-27(41-29)35-22-23(2)30(38)34-32(35)40/h16-17,19,21-22,26-29,37H,3-15,18,20H2,1-2H3,(H,34,38,40)