5-acetamido-3-[3-diazenyl-4-(2-hydroxyethyloxy)phenyl]-4-oxidanyl-naphthalene-2,7-disulfonic acid

Systemtic Name: 5-acetamido-3-[3-diazenyl-4-(2-hydroxyethyloxy)phenyl]-4-oxidanyl-naphthalene-2,7-disulfonic acid Openeye Name: 5-acetamido-3-[3-diazenyl-4-(2-hydroxyethoxy)phenyl]-4-hydroxy-naphthalene-2,7-disulfonic acid CAS Name: 5-acetamido-3-[3-diazenyl-4-(2-hydroxyethoxy)phenyl]-4-hydroxynaphthalene-2,7-disulfonic acid IUPAC Name: 5-acetamido-3-[3-diazenyl-4-(2-hydroxyethoxy)phenyl]-4-hydroxynaphthalene-2,7-disulfonic acid Traditional Name: 5-acetamido-3-[3-diazenyl-4-(2-hydroxyethoxy)phenyl]-4-hydroxy-naphthalene-2,7-disulfonic acid Formula: C20H19N3O10S2 MolecularWeight: 525.50896

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C(=C2O)C3=CC(=C(C=C3)OCCO)N=N)S(=O)(=O)O

Isomeric SMILES

CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C(=C2O)C3=CC(=C(C=C3)OCCO)N=N)S(=O)(=O)O

InChI

InChI=1S/C20H19N3O10S2/c1-10(25)22-15-9-13(34(27,28)29)6-12-8-17(35(30,31)32)19(20(26)18(12)15)11-2-3-16(33-5-4-24)14(7-11)23-21/h2-3,6-9,21,24,26H,4-5H2,1H3,(H,22,25)(H,27,28,29)(H,30,31,32)