(3E)-3-[(4-azanyl-2-sulfo-phenyl)hydrazinylidene]-4-oxidanylidene-5-phenylazanyl-naphthalene-2,7-disulfonic acid

Systemtic Name: (3E)-3-[(4-azanyl-2-sulfo-phenyl)hydrazinylidene]-4-oxidanylidene-5-phenylazanyl-naphthalene-2,7-disulfonic acid Openeye Name: (3E)-3-[(4-amino-2-sulfo-phenyl)hydrazono]-5-anilino-4-oxo-naphthalene-2,7-disulfonic acid CAS Name: (3E)-3-[(4-amino-2-sulfophenyl)hydrazinylidene]-5-anilino-4-oxonaphthalene-2,7-disulfonic acid IUPAC Name: (3E)-3-[(4-amino-2-sulfophenyl)hydrazinylidene]-5-anilino-4-oxonaphthalene-2,7-disulfonic acid Traditional Name: (3E)-3-[(4-amino-2-sulfo-phenyl)hydrazono]-5-anilino-4-keto-naphthalene-2,7-disulfonic acid Formula: C22H18N4O10S3 MolecularWeight: 594.59412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C(=NNC4=C(C=C(C=C4)N)S(=O)(=O)O)C3=O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(/C(=N/NC4=C(C=C(C=C4)N)S(=O)(=O)O)/C3=O)S(=O)(=O)O

InChI

InChI=1S/C22H18N4O10S3/c23-13-6-7-16(18(10-13)38(31,32)33)25-26-21-19(39(34,35)36)9-12-8-15(37(28,29)30)11-17(20(12)22(21)27)24-14-4-2-1-3-5-14/h1-11,24-25H,23H2,(H,28,29,30)(H,31,32,33)(H,34,35,36)/b26-21-