(3E)-4-azanyl-3-[(3,6-disulfonylcyclohexa-1,4-dien-1-yl)hydrazinylidene]-5-oxidanylidene-naphthalene-2,7-disulfonic acid

Systemtic Name: (3E)-4-azanyl-3-[(3,6-disulfonylcyclohexa-1,4-dien-1-yl)hydrazinylidene]-5-oxidanylidene-naphthalene-2,7-disulfonic acid Openeye Name: (3E)-4-amino-3-[(3,6-disulfonylcyclohexa-1,4-dien-1-yl)hydrazono]-5-oxo-naphthalene-2,7-disulfonic acid CAS Name: (3E)-4-amino-3-[(3,6-disulfonyl-1-cyclohexa-1,4-dienyl)hydrazinylidene]-5-oxonaphthalene-2,7-disulfonic acid IUPAC Name: (3E)-4-amino-3-[(3,6-disulfonylcyclohexa-1,4-dien-1-yl)hydrazinylidene]-5-oxonaphthalene-2,7-disulfonic acid Traditional Name: (3E)-4-amino-3-[(3,6-disulfonylcyclohexa-1,4-dien-1-yl)hydrazono]-5-keto-naphthalene-2,7-disulfonic acid Formula: C16H11N3O11S4 MolecularWeight: 549.53204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=S(=O)=O)C(=CC1=S(=O)=O)NN=C2C(=CC3=CC(=CC(=O)C3=C2N)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=S(=O)=O)C(=CC1=S(=O)=O)N/N=C\2/C(=CC3=CC(=CC(=O)C3=C2N)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C16H11N3O11S4/c17-15-14-7(3-9(6-11(14)20)33(25,26)27)4-13(34(28,29)30)16(15)19-18-10-5-8(31(21)22)1-2-12(10)32(23)24/h1-6,18H,17H2,(H,25,26,27)(H,28,29,30)/b19-16-