(3E)-6-azanyl-4-oxidanylidene-3-[[4-[(4-phenyldiazenyl-7-sulfo-naphthalen-1-yl)diazenyl]-7-sulfo-naphthalen-1-yl]hydrazinylidene]naphthalene-2-sulfonic acid

Systemtic Name: (3E)-6-azanyl-4-oxidanylidene-3-[[4-[(4-phenyldiazenyl-7-sulfo-naphthalen-1-yl)diazenyl]-7-sulfo-naphthalen-1-yl]hydrazinylidene]naphthalene-2-sulfonic acid Openeye Name: (3E)-6-amino-4-oxo-3-[[4-[(4-phenylazo-7-sulfo-1-naphthyl)azo]-7-sulfo-1-naphthyl]hydrazono]naphthalene-2-sulfonic acid CAS Name: (3E)-6-amino-4-oxo-3-[[4-[(4-phenyldiazenyl-7-sulfo-1-naphthalenyl)azo]-7-sulfo-1-naphthalenyl]hydrazinylidene]-2-naphthalenesulfonic acid IUPAC Name: (3E)-6-amino-4-oxo-3-[[4-[(4-phenyldiazenyl-7-sulfonaphthalen-1-yl)diazenyl]-7-sulfonaphthalen-1-yl]hydrazinylidene]naphthalene-2-sulfonic acid Traditional Name: (3E)-6-amino-4-keto-3-[[4-[(4-phenylazo-7-sulfo-1-naphthyl)azo]-7-sulfo-1-naphthyl]hydrazono]naphthalene-2-sulfonic acid Formula: C36H25N7O10S3 MolecularWeight: 811.8196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=C3C=CC(=CC3=C(C=C2)N=NC4=C5C=CC(=CC5=C(C=C4)NN=C6C(=CC7=C(C6=O)C=C(C=C7)N)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=C3C=CC(=CC3=C(C=C2)N=NC4=C5C=CC(=CC5=C(C=C4)N/N=C\6/C(=CC7=C(C6=O)C=C(C=C7)N)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C36H25N7O10S3/c37-21-7-6-20-16-34(56(51,52)53)35(36(44)27(20)17-21)43-42-33-15-13-31(26-11-9-24(19-29(26)33)55(48,49)50)40-41-32-14-12-30(39-38-22-4-2-1-3-5-22)25-10-8-23(18-28(25)32)54(45,46)47/h1-19,42H,37H2,(H,45,46,47)(H,48,49,50)(H,51,52,53)/b39-38?,41-40?,43-35-