1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-5-oct-1-ynyl-imidazole-4-carbonitrile

Systemtic Name: 1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-5-oct-1-ynyl-imidazole-4-carbonitrile Openeye Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-oct-1-ynyl-imidazole-4-carbonitrile CAS Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-oct-1-ynyl-4-imidazolecarbonitrile IUPAC Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-oct-1-ynylimidazole-4-carbonitrile Traditional Name: 1-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)-5-oct-1-ynyl-imidazole-4-carbonitrile Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=C(N=CN1C2C(C(C(O2)CO)O)O)C#N

Isomeric SMILES

CCCCCCC#CC1=C(N=CN1C2C(C(C(O2)CO)O)O)C#N

InChI

InChI=1S/C17H23N3O4/c1-2-3-4-5-6-7-8-13-12(9-18)19-11-20(13)17-16(23)15(22)14(10-21)24-17/h11,14-17,21-23H,2-6,10H2,1H3