5-hept-1-ynyl-1-[(1R,2R,4S)-4-(hydroxymethyl)-2-oxidanyl-cyclopentyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-hept-1-ynyl-1-[(1R,2R,4S)-4-(hydroxymethyl)-2-oxidanyl-cyclopentyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-hept-1-ynyl-1-[(1R,2R,4S)-2-hydroxy-4-(hydroxymethyl)cyclopentyl]triazole-4-carboxamide CAS Name: 5-hept-1-ynyl-1-[(1R,2R,4S)-2-hydroxy-4-(hydroxymethyl)cyclopentyl]-4-triazolecarboxamide IUPAC Name: 5-hept-1-ynyl-1-[(1R,2R,4S)-2-hydroxy-4-(hydroxymethyl)cyclopentyl]triazole-4-carboxamide Traditional Name: 5-hept-1-ynyl-1-[(1R,2R,4S)-2-hydroxy-4-methylol-cyclopentyl]triazole-4-carboxamide Formula: C16H24N4O3 MolecularWeight: 320.38676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC1=C(N=NN1C2CC(CC2O)CO)C(=O)N

Isomeric SMILES

CCCCCC#CC1=C(N=NN1[C@@H]2C[C@@H](C[C@H]2O)CO)C(=O)N

InChI

InChI=1S/C16H24N4O3/c1-2-3-4-5-6-7-12-15(16(17)23)18-19-20(12)13-8-11(10-21)9-14(13)22/h11,13-14,21-22H,2-5,8-10H2,1H3,(H2,17,23)/t11-,13+,14+/m0/s1