3-(ethylamino)-5-oxidanyl-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid

Systemtic Name: 3-(ethylamino)-5-oxidanyl-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid Openeye Name: 3-(ethylamino)-5-hydroxy-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid CAS Name: 3-(ethylamino)-5-hydroxy-7-(trioxidanylthio)-2-naphthalenesulfonic acid IUPAC Name: 3-(ethylamino)-5-hydroxy-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid Traditional Name: 3-(ethylamino)-5-hydroxy-7-(trioxidanylthio)naphthalene-2-sulfonic acid Formula: C12H13NO7S2 MolecularWeight: 347.36412

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C=C(C=C(C2=C1)O)SOOO)S(=O)(=O)O

Isomeric SMILES

CCNC1=C(C=C2C=C(C=C(C2=C1)O)SOOO)S(=O)(=O)O

InChI

InChI=1S/C12H13NO7S2/c1-2-13-10-6-9-7(4-12(10)22(16,17)18)3-8(5-11(9)14)21-20-19-15/h3-6,13-15H,2H2,1H3,(H,16,17,18)