7-[(3,4-dimethoxyphenyl)methyl]-2-oxidanyl-6-oxidanylidene-4,7-diazabicyclo[3.2.0]heptane-5-carboxylate

Systemtic Name: 7-[(3,4-dimethoxyphenyl)methyl]-2-oxidanyl-6-oxidanylidene-4,7-diazabicyclo[3.2.0]heptane-5-carboxylate Openeye Name: 7-[(3,4-dimethoxyphenyl)methyl]-2-hydroxy-6-oxo-4,7-diazabicyclo[3.2.0]heptane-5-carboxylate CAS Name: 7-[(3,4-dimethoxyphenyl)methyl]-2-hydroxy-6-oxo-4,7-diazabicyclo[3.2.0]heptane-5-carboxylate IUPAC Name: 7-[(3,4-dimethoxyphenyl)methyl]-2-hydroxy-6-oxo-4,7-diazabicyclo[3.2.0]heptane-5-carboxylate Traditional Name: 2-hydroxy-6-keto-7-veratryl-4,7-diazabicyclo[3.2.0]heptane-5-carboxylate Formula: C15H17N2O6- MolecularWeight: 321.30528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C3C(CNC3(C2=O)C(=O)[O-])O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C3C(CNC3(C2=O)C(=O)[O-])O)OC

InChI

InChI=1S/C15H18N2O6/c1-22-10-4-3-8(5-11(10)23-2)7-17-12-9(18)6-16-15(12,13(17)19)14(20)21/h3-5,9,12,16,18H,6-7H2,1-2H3,(H,20,21)/p-1