1-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]-5-tridec-1-ynyl-pyrimidine-2,4-dione

Systemtic Name: 1-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]-5-tridec-1-ynyl-pyrimidine-2,4-dione Openeye Name: 1-[(2R,5S)-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-tridec-1-ynyl-pyrimidine-2,4-dione CAS Name: 1-[(2R,5S)-5-(hydroxymethyl)-2-oxolanyl]-5-tridec-1-ynylpyrimidine-2,4-dione IUPAC Name: 1-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]-5-tridec-1-ynylpyrimidine-2,4-dione Traditional Name: 1-[(2R,5S)-5-methyloltetrahydrofuran-2-yl]-5-tridec-1-ynyl-pyrimidine-2,4-quinone Formula: C22H34N2O4 MolecularWeight: 390.51636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC#CC1=CN(C(=O)NC1=O)C2CCC(O2)CO

Isomeric SMILES

CCCCCCCCCCCC#CC1=CN(C(=O)NC1=O)[C@H]2CC[C@H](O2)CO

InChI

InChI=1S/C22H34N2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-18-16-24(22(27)23-21(18)26)20-15-14-19(17-25)28-20/h16,19-20,25H,2-11,14-15,17H2,1H3,(H,23,26,27)/t19-,20+/m0/s1