4-(ethylamino)-5-oxidanyl-naphthalene-2,7-disulfonic acid

Systemtic Name: 4-(ethylamino)-5-oxidanyl-naphthalene-2,7-disulfonic acid Openeye Name: 4-(ethylamino)-5-hydroxy-naphthalene-2,7-disulfonic acid CAS Name: 4-(ethylamino)-5-hydroxynaphthalene-2,7-disulfonic acid IUPAC Name: 4-(ethylamino)-5-hydroxynaphthalene-2,7-disulfonic acid Traditional Name: 4-(ethylamino)-5-hydroxy-naphthalene-2,7-disulfonic acid Formula: C12H13NO7S2 MolecularWeight: 347.36412

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C=C2O)S(=O)(=O)O

Isomeric SMILES

CCNC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C=C2O)S(=O)(=O)O

InChI

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