(3Z)-4-azanyl-3-[(2,5-disulfophenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-2,7-disulfonic acid

Systemtic Name: (3Z)-4-azanyl-3-[(2,5-disulfophenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-2,7-disulfonic acid Openeye Name: (3Z)-4-amino-3-[(2,5-disulfophenyl)hydrazono]-5-oxo-naphthalene-2,7-disulfonic acid CAS Name: (3Z)-4-amino-3-[(2,5-disulfophenyl)hydrazinylidene]-5-oxonaphthalene-2,7-disulfonic acid IUPAC Name: (3Z)-4-amino-3-[(2,5-disulfophenyl)hydrazinylidene]-5-oxonaphthalene-2,7-disulfonic acid Traditional Name: (3Z)-4-amino-3-[(2,5-disulfophenyl)hydrazono]-5-keto-naphthalene-2,7-disulfonic acid Formula: C16H13N3O13S4 MolecularWeight: 583.54672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)O)NN=C2C(=CC3=CC(=CC(=O)C3=C2N)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)O)N/N=C/2\C(=CC3=CC(=CC(=O)C3=C2N)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C16H13N3O13S4/c17-15-14-7(3-9(6-11(14)20)34(24,25)26)4-13(36(30,31)32)16(15)19-18-10-5-8(33(21,22)23)1-2-12(10)35(27,28)29/h1-6,18H,17H2,(H,21,22,23)(H,24,25,26)(H,27,28,29)(H,30,31,32)/b19-16+