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

Systemtic Name: (3Z)-4-azanyl-3-[(4-iodophenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-2,7-disulfonic acid Openeye Name: (3Z)-4-amino-3-[(4-iodophenyl)hydrazono]-5-oxo-naphthalene-2,7-disulfonic acid CAS Name: (3Z)-4-amino-3-[(4-iodophenyl)hydrazinylidene]-5-oxonaphthalene-2,7-disulfonic acid IUPAC Name: (3Z)-4-amino-3-[(4-iodophenyl)hydrazinylidene]-5-oxonaphthalene-2,7-disulfonic acid Traditional Name: (3Z)-4-amino-3-[(4-iodophenyl)hydrazono]-5-keto-naphthalene-2,7-disulfonic acid Formula: C16H12IN3O7S2 MolecularWeight: 549.31685

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NN=C2C(=CC3=CC(=CC(=O)C3=C2N)S(=O)(=O)O)S(=O)(=O)O)I

Isomeric SMILES

C1=CC(=CC=C1N/N=C/2\C(=CC3=CC(=CC(=O)C3=C2N)S(=O)(=O)O)S(=O)(=O)O)I

InChI

InChI=1S/C16H12IN3O7S2/c17-9-1-3-10(4-2-9)19-20-16-13(29(25,26)27)6-8-5-11(28(22,23)24)7-12(21)14(8)15(16)18/h1-7,19H,18H2,(H,22,23,24)(H,25,26,27)/b20-16+