disodium (6Z)-3-[(4-aminophenyl)diazenyl]-6-[(4-aminophenyl)hydrazinylidene]-4-azanyl-5-oxidanylidene-naphthalene-2,7-disulfonate

Systemtic Name: disodium (6Z)-3-[(4-aminophenyl)diazenyl]-6-[(4-aminophenyl)hydrazinylidene]-4-azanyl-5-oxidanylidene-naphthalene-2,7-disulfonate Openeye Name: disodium (6Z)-4-amino-3-(4-aminophenyl)azo-6-[(4-aminophenyl)hydrazono]-5-oxo-naphthalene-2,7-disulfonate CAS Name: disodium (6Z)-4-amino-3-(4-aminophenyl)azo-6-[(4-aminophenyl)hydrazinylidene]-5-oxonaphthalene-2,7-disulfonate IUPAC Name: disodium (6Z)-4-amino-3-[(4-aminophenyl)diazenyl]-6-[(4-aminophenyl)hydrazinylidene]-5-oxonaphthalene-2,7-disulfonate Traditional Name: disodium (6Z)-4-amino-3-(4-aminophenyl)azo-6-[(4-aminophenyl)hydrazono]-5-keto-naphthalene-2,7-disulfonate Formula: C22H17N7Na2O7S2 MolecularWeight: 601.52262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)NN=C2C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1N)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C22H19N7O7S2.2Na/c23-12-1-5-14(6-2-12)26-28-20-16(37(31,32)33)9-11-10-17(38(34,35)36)21(22(30)18(11)19(20)25)29-27-15-7-3-13(24)4-8-15;;/h1-10,27H,23-25H2,(H,31,32,33)(H,34,35,36);;/q;2*+1/p-2/b28-26?,29-21+;;