(6E)-4-azanyl-6-[(4-iodophenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-1,3-disulfonic acid

Systemtic Name: (6E)-4-azanyl-6-[(4-iodophenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-1,3-disulfonic acid Openeye Name: (6E)-4-amino-6-[(4-iodophenyl)hydrazono]-5-oxo-naphthalene-1,3-disulfonic acid CAS Name: (6E)-4-amino-6-[(4-iodophenyl)hydrazinylidene]-5-oxonaphthalene-1,3-disulfonic acid IUPAC Name: (6E)-4-amino-6-[(4-iodophenyl)hydrazinylidene]-5-oxonaphthalene-1,3-disulfonic acid Traditional Name: (6E)-4-amino-6-[(4-iodophenyl)hydrazono]-5-keto-naphthalene-1,3-disulfonic acid Formula: C16H12IN3O7S2 MolecularWeight: 549.31685

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NN=C2C=CC3=C(C2=O)C(=C(C=C3S(=O)(=O)O)S(=O)(=O)O)N)I

Isomeric SMILES

C1=CC(=CC=C1N/N=C/2\C=CC3=C(C2=O)C(=C(C=C3S(=O)(=O)O)S(=O)(=O)O)N)I

InChI

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