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

Systemtic Name: (3Z)-3-[(4-acetamido-2-sulfo-phenyl)hydrazinylidene]-5-azanyl-4-oxidanylidene-naphthalene-2,7-disulfonic acid Openeye Name: (3Z)-3-[(4-acetamido-2-sulfo-phenyl)hydrazono]-5-amino-4-oxo-naphthalene-2,7-disulfonic acid CAS Name: (3Z)-3-[(4-acetamido-2-sulfophenyl)hydrazinylidene]-5-amino-4-oxonaphthalene-2,7-disulfonic acid IUPAC Name: (3Z)-3-[(4-acetamido-2-sulfophenyl)hydrazinylidene]-5-amino-4-oxonaphthalene-2,7-disulfonic acid Traditional Name: (3Z)-3-[(4-acetamido-2-sulfo-phenyl)hydrazono]-5-amino-4-keto-naphthalene-2,7-disulfonic acid Formula: C18H16N4O11S3 MolecularWeight: 560.53484

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)NN=C2C(=CC3=CC(=CC(=C3C2=O)N)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)N)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C18H16N4O11S3/c1-8(23)20-10-2-3-13(14(6-10)35(28,29)30)21-22-17-15(36(31,32)33)5-9-4-11(34(25,26)27)7-12(19)16(9)18(17)24/h2-7,21H,19H2,1H3,(H,20,23)(H,25,26,27)(H,28,29,30)(H,31,32,33)/b22-17+