6-(oxan-2-yloxymethyl)-7-oxidanylidene-6-(1-oxidanylpent-4-en-2-yl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 6-(oxan-2-yloxymethyl)-7-oxidanylidene-6-(1-oxidanylpent-4-en-2-yl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 6-[1-(hydroxymethyl)but-3-enyl]-7-oxo-6-(tetrahydropyran-2-yloxymethyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 6-(1-hydroxypent-4-en-2-yl)-6-(2-oxanyloxymethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 6-(1-hydroxypent-4-en-2-yl)-6-(oxan-2-yloxymethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 7-keto-6-(1-methylolbut-3-enyl)-6-(tetrahydropyran-2-yloxymethyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C17H23NO6S MolecularWeight: 369.43262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CO)C1(C2N(C1=O)C(=CS2)C(=O)O)COC3CCCCO3

Isomeric SMILES

C=CCC(CO)C1(C2N(C1=O)C(=CS2)C(=O)O)COC3CCCCO3

InChI

InChI=1S/C17H23NO6S/c1-2-5-11(8-19)17(10-24-13-6-3-4-7-23-13)15(22)18-12(14(20)21)9-25-16(17)18/h2,9,11,13,16,19H,1,3-8,10H2,(H,20,21)