(3E)-3-(4,6-diphenyl-1H-1,3,5-triazin-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-diene-1-sulfonic acid

Systemtic Name: (3E)-3-(4,6-diphenyl-1H-1,3,5-triazin-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-diene-1-sulfonic acid Openeye Name: (3E)-3-(4,6-diphenyl-1H-1,3,5-triazin-2-ylidene)-4-oxo-cyclohexa-1,5-diene-1-sulfonic acid CAS Name: (3E)-3-(4,6-diphenyl-1H-1,3,5-triazin-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienesulfonic acid IUPAC Name: (3E)-3-(4,6-diphenyl-1H-1,3,5-triazin-2-ylidene)-4-oxocyclohexa-1,5-diene-1-sulfonic acid Traditional Name: (3E)-3-(4,6-diphenyl-1H-s-triazin-2-ylidene)-4-keto-cyclohexa-1,5-diene-1-sulfonic acid Formula: C21H15N3O4S MolecularWeight: 405.4265

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC(=C3C=C(C=CC3=O)S(=O)(=O)O)N2)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=N/C(=C/3\C=C(C=CC3=O)S(=O)(=O)O)/N2)C4=CC=CC=C4

InChI

InChI=1S/C21H15N3O4S/c25-18-12-11-16(29(26,27)28)13-17(18)21-23-19(14-7-3-1-4-8-14)22-20(24-21)15-9-5-2-6-10-15/h1-13H,(H,22,23,24)(H,26,27,28)