disodium 7-[(4-aminophenyl)diazenyl]naphthalene-1,3-disulfonate

Systemtic Name: disodium 7-[(4-aminophenyl)diazenyl]naphthalene-1,3-disulfonate Openeye Name: disodium 7-(4-aminophenyl)azonaphthalene-1,3-disulfonate CAS Name: disodium 7-(4-aminophenyl)azonaphthalene-1,3-disulfonate IUPAC Name: disodium 7-[(4-aminophenyl)diazenyl]naphthalene-1,3-disulfonate Traditional Name: disodium 7-(4-aminophenyl)azonaphthalene-1,3-disulfonate Formula: C16H11N3Na2O6S2 MolecularWeight: 451.38458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1N)N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

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