sodium 3-azanyl-4-phenyldiazenyl-naphthalene-2,7-disulfonic acid

Systemtic Name: sodium 3-azanyl-4-phenyldiazenyl-naphthalene-2,7-disulfonic acid Openeye Name: sodium 3-amino-4-phenylazo-naphthalene-2,7-disulfonic acid CAS Name: sodium 3-amino-4-phenyldiazenylnaphthalene-2,7-disulfonic acid IUPAC Name: sodium 3-amino-4-phenyldiazenylnaphthalene-2,7-disulfonic acid Traditional Name: sodium 3-amino-4-phenylazo-naphthalene-2,7-disulfonic acid Formula: C16H13N3NaO6S2+ MolecularWeight: 430.41069

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=C3C=CC(=CC3=CC(=C2N)S(=O)(=O)O)S(=O)(=O)O.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=C3C=CC(=CC3=CC(=C2N)S(=O)(=O)O)S(=O)(=O)O.[Na+]

InChI

InChI=1S/C16H13N3O6S2.Na/c17-15-14(27(23,24)25)9-10-8-12(26(20,21)22)6-7-13(10)16(15)19-18-11-4-2-1-3-5-11;/h1-9H,17H2,(H,20,21,22)(H,23,24,25);/q;+1