4-azanyl-5-[(2-sulfophenyl)diazenyl]naphthalene-2,7-disulfonic acid

Systemtic Name: 4-azanyl-5-[(2-sulfophenyl)diazenyl]naphthalene-2,7-disulfonic acid Openeye Name: 4-amino-5-(2-sulfophenyl)azo-naphthalene-2,7-disulfonic acid CAS Name: 4-amino-5-(2-sulfophenyl)azonaphthalene-2,7-disulfonic acid IUPAC Name: 4-amino-5-[(2-sulfophenyl)diazenyl]naphthalene-2,7-disulfonic acid Traditional Name: 4-amino-5-(2-sulfophenyl)azo-naphthalene-2,7-disulfonic acid Formula: C16H13N3O9S3 MolecularWeight: 487.48412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N=NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3N)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)N=NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3N)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C16H13N3O9S3/c17-12-7-10(29(20,21)22)5-9-6-11(30(23,24)25)8-14(16(9)12)19-18-13-3-1-2-4-15(13)31(26,27)28/h1-8H,17H2,(H,20,21,22)(H,23,24,25)(H,26,27,28)