1-[(2R,4S,5R)-5-(hept-1-ynoxymethyl)-4-oxidanyl-oxolan-2-yl]pyrimidine-2,4-dione

Systemtic Name: 1-[(2R,4S,5R)-5-(hept-1-ynoxymethyl)-4-oxidanyl-oxolan-2-yl]pyrimidine-2,4-dione Openeye Name: 1-[(2R,4S,5R)-5-(hept-1-ynoxymethyl)-4-hydroxy-tetrahydrofuran-2-yl]pyrimidine-2,4-dione CAS Name: 1-[(2R,4S,5R)-5-(hept-1-ynoxymethyl)-4-hydroxy-2-oxolanyl]pyrimidine-2,4-dione IUPAC Name: 1-[(2R,4S,5R)-5-(hept-1-ynoxymethyl)-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione Traditional Name: 1-[(2R,4S,5R)-5-(hept-1-ynoxymethyl)-4-hydroxy-tetrahydrofuran-2-yl]pyrimidine-2,4-quinone Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#COCC1C(CC(O1)N2C=CC(=O)NC2=O)O

Isomeric SMILES

CCCCCC#COC[C@@H]1[C@H](C[C@@H](O1)N2C=CC(=O)NC2=O)O

InChI

InChI=1S/C16H22N2O5/c1-2-3-4-5-6-9-22-11-13-12(19)10-15(23-13)18-8-7-14(20)17-16(18)21/h7-8,12-13,15,19H,2-5,10-11H2,1H3,(H,17,20,21)/t12-,13+,15+/m0/s1