4-azanyl-6-azabicyclo[3.2.1]octa-1(8),2,4-trien-7-one; 5-oxidanylnaphthalene-1-sulfonic acid

Systemtic Name: 4-azanyl-6-azabicyclo[3.2.1]octa-1(8),2,4-trien-7-one; 5-oxidanylnaphthalene-1-sulfonic acid Openeye Name: 4-amino-6-azabicyclo[3.2.1]octa-1(8),2,4-trien-7-one; 5-hydroxynaphthalene-1-sulfonic acid CAS Name: 4-amino-6-azabicyclo[3.2.1]octa-1(8),2,4-trien-7-one; 5-hydroxy-1-naphthalenesulfonic acid IUPAC Name: 4-amino-6-azabicyclo[3.2.1]octa-1(8),2,4-trien-7-one; 5-hydroxynaphthalene-1-sulfonic acid Traditional Name: 4-amino-6-azabicyclo[3.2.1]octa-1(8),2,4-trien-7-one; 5-hydroxynaphthalene-1-sulfonic acid Formula: C17H14N2O5S MolecularWeight: 358.36846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=C2S(=O)(=O)O)C(=C1)O.C1=CC(=C2C=C1C(=O)N2)N

Isomeric SMILES

C1=CC2=C(C=CC=C2S(=O)(=O)O)C(=C1)O.C1=CC(=C2C=C1C(=O)N2)N

InChI

InChI=1S/C10H8O4S.C7H6N2O/c11-9-5-1-4-8-7(9)3-2-6-10(8)15(12,13)14;8-5-2-1-4-3-6(5)9-7(4)10/h1-6,11H,(H,12,13,14);1-3H,8H2,(H,9,10)