(3E)-6-acetamido-4-oxidanylidene-3-[[4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]naphthalene-2-sulfonic acid

Systemtic Name: (3E)-6-acetamido-4-oxidanylidene-3-[[4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]naphthalene-2-sulfonic acid Openeye Name: (3E)-6-acetamido-4-oxo-3-[[4-(2-sulfooxyethylsulfonyl)phenyl]hydrazono]naphthalene-2-sulfonic acid CAS Name: (3E)-6-acetamido-4-oxo-3-[[4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-2-naphthalenesulfonic acid IUPAC Name: (3E)-6-acetamido-4-oxo-3-[[4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]naphthalene-2-sulfonic acid Traditional Name: (3E)-6-acetamido-4-keto-3-[[4-(2-sulfoxyethylsulfonyl)phenyl]hydrazono]naphthalene-2-sulfonic acid Formula: C20H19N3O11S3 MolecularWeight: 573.57336

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C=C(C(=NNC3=CC=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O)C2=O)S(=O)(=O)O

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C=C(/C(=N/NC3=CC=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O)/C2=O)S(=O)(=O)O

InChI

InChI=1S/C20H19N3O11S3/c1-12(24)21-15-3-2-13-10-18(36(28,29)30)19(20(25)17(13)11-15)23-22-14-4-6-16(7-5-14)35(26,27)9-8-34-37(31,32)33/h2-7,10-11,22H,8-9H2,1H3,(H,21,24)(H,28,29,30)(H,31,32,33)/b23-19-