5-aminocarbonyl-2-(7-azabicyclo[2.2.1]hepta-1,3,5-trien-7-ylcarbonyl)benzenesulfonic acid

Systemtic Name: 5-aminocarbonyl-2-(7-azabicyclo[2.2.1]hepta-1,3,5-trien-7-ylcarbonyl)benzenesulfonic acid Openeye Name: 2-(7-azabicyclo[2.2.1]hepta-1,3,5-triene-7-carbonyl)-5-carbamoyl-benzenesulfonic acid CAS Name: 2-[7-azabicyclo[2.2.1]hepta-1,3,5-trien-7-yl(oxo)methyl]-5-carbamoylbenzenesulfonic acid IUPAC Name: 2-(7-azabicyclo[2.2.1]hepta-1,3,5-triene-7-carbonyl)-5-carbamoylbenzenesulfonic acid Traditional Name: 2-(7-azabicyclo[2.2.1]hepta-1,3,5-triene-7-carbonyl)-5-carbamoyl-besylic acid Formula: C14H10N2O5S MolecularWeight: 318.3046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC=C1N2C(=O)C3=C(C=C(C=C3)C(=O)N)S(=O)(=O)O

Isomeric SMILES

C1=CC2=CC=C1N2C(=O)C3=C(C=C(C=C3)C(=O)N)S(=O)(=O)O

InChI

InChI=1S/C14H10N2O5S/c15-13(17)8-1-6-11(12(7-8)22(19,20)21)14(18)16-9-2-3-10(16)5-4-9/h1-7H,(H2,15,17)(H,19,20,21)