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

Systemtic Name: 5-dec-1-ynyl-1-[(1R,2R,4S)-4-(hydroxymethyl)-2-oxidanyl-cyclopentyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-dec-1-ynyl-1-[(1R,2R,4S)-2-hydroxy-4-(hydroxymethyl)cyclopentyl]triazole-4-carboxamide CAS Name: 5-dec-1-ynyl-1-[(1R,2R,4S)-2-hydroxy-4-(hydroxymethyl)cyclopentyl]-4-triazolecarboxamide IUPAC Name: 5-dec-1-ynyl-1-[(1R,2R,4S)-2-hydroxy-4-(hydroxymethyl)cyclopentyl]triazole-4-carboxamide Traditional Name: 5-dec-1-ynyl-1-[(1R,2R,4S)-2-hydroxy-4-methylol-cyclopentyl]triazole-4-carboxamide Formula: C19H30N4O3 MolecularWeight: 362.4665

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30N4O3/c1-2-3-4-5-6-7-8-9-10-15-18(19(20)26)21-22-23(15)16-11-14(13-24)12-17(16)25/h14,16-17,24-25H,2-8,11-13H2,1H3,(H2,20,26)/t14-,16+,17+/m0/s1