(3E)-5-acetamido-3-[(4-ethenylsulfonyl-2-oxidanyl-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2,7-disulfonic acid

Systemtic Name: (3E)-5-acetamido-3-[(4-ethenylsulfonyl-2-oxidanyl-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2,7-disulfonic acid Openeye Name: (3E)-5-acetamido-3-[(2-hydroxy-4-vinylsulfonyl-phenyl)hydrazono]-4-oxo-naphthalene-2,7-disulfonic acid CAS Name: (3E)-5-acetamido-3-[(4-ethenylsulfonyl-2-hydroxyphenyl)hydrazinylidene]-4-oxonaphthalene-2,7-disulfonic acid IUPAC Name: (3E)-5-acetamido-3-[(4-ethenylsulfonyl-2-hydroxyphenyl)hydrazinylidene]-4-oxonaphthalene-2,7-disulfonic acid Traditional Name: (3E)-5-acetamido-3-[(2-hydroxy-4-vinylsulfonyl-phenyl)hydrazono]-4-keto-naphthalene-2,7-disulfonic acid Formula: C20H17N3O11S3 MolecularWeight: 571.55748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C(=NNC3=C(C=C(C=C3)S(=O)(=O)C=C)O)C2=O)S(=O)(=O)O

Isomeric SMILES

CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(/C(=N/NC3=C(C=C(C=C3)S(=O)(=O)C=C)O)/C2=O)S(=O)(=O)O

InChI

InChI=1S/C20H17N3O11S3/c1-3-35(27,28)12-4-5-14(16(25)9-12)22-23-19-17(37(32,33)34)7-11-6-13(36(29,30)31)8-15(21-10(2)24)18(11)20(19)26/h3-9,22,25H,1H2,2H3,(H,21,24)(H,29,30,31)(H,32,33,34)/b23-19-