disodium (3E)-7-azanyl-3-[[2-methoxy-4-[(3-sulfonatophenyl)diazenyl]phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: disodium (3E)-7-azanyl-3-[[2-methoxy-4-[(3-sulfonatophenyl)diazenyl]phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate Openeye Name: disodium (3E)-7-amino-3-[[2-methoxy-4-(3-sulfonatophenyl)azo-phenyl]hydrazono]-4-oxo-naphthalene-2-sulfonate CAS Name: disodium (3E)-7-amino-3-[[2-methoxy-4-(3-sulfonatophenyl)azophenyl]hydrazinylidene]-4-oxo-2-naphthalenesulfonate IUPAC Name: disodium (3E)-7-amino-3-[[2-methoxy-4-[(3-sulfonatophenyl)diazenyl]phenyl]hydrazinylidene]-4-oxonaphthalene-2-sulfonate Traditional Name: disodium (3E)-7-amino-4-keto-3-[[2-methoxy-4-(3-sulfonatophenyl)azo-phenyl]hydrazono]naphthalene-2-sulfonate Formula: C23H17N5Na2O8S2 MolecularWeight: 601.51932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)[O-])NN=C3C(=CC4=C(C3=O)C=CC(=C4)N)S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)[O-])N/N=C\3/C(=CC4=C(C3=O)C=CC(=C4)N)S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C23H19N5O8S2.2Na/c1-36-20-12-16(26-25-15-3-2-4-17(11-15)37(30,31)32)6-8-19(20)27-28-22-21(38(33,34)35)10-13-9-14(24)5-7-18(13)23(22)29;;/h2-12,27H,24H2,1H3,(H,30,31,32)(H,33,34,35);;/q;2*+1/p-2/b26-25?,28-22-;;