3-[2-(1-hydroxyethyl)-5-methyl-phenyl]sulfonyloxy-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 3-[2-(1-hydroxyethyl)-5-methyl-phenyl]sulfonyloxy-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 3-[2-(1-hydroxyethyl)-5-methyl-phenyl]sulfonyloxy-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 3-[2-(1-hydroxyethyl)-5-methylphenyl]sulfonyloxy-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 3-[2-(1-hydroxyethyl)-5-methylphenyl]sulfonyloxy-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 3-[2-(1-hydroxyethyl)-5-methyl-phenyl]sulfonyloxy-7-keto-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C16H17NO7S MolecularWeight: 367.37368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)O)S(=O)(=O)OC2=C(N3C(C2)CC3=O)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)O)S(=O)(=O)OC2=C(N3C(C2)CC3=O)C(=O)O

InChI

InChI=1S/C16H17NO7S/c1-8-3-4-11(9(2)18)13(5-8)25(22,23)24-12-6-10-7-14(19)17(10)15(12)16(20)21/h3-5,9-10,18H,6-7H2,1-2H3,(H,20,21)