3-[(4,6-diphenoxy-1,3,5-triazin-2-yl)amino]benzoic acid

Systemtic Name: 3-[(4,6-diphenoxy-1,3,5-triazin-2-yl)amino]benzoic acid Openeye Name: 3-[(4,6-diphenoxy-1,3,5-triazin-2-yl)amino]benzoic acid CAS Name: 3-[(4,6-diphenoxy-1,3,5-triazin-2-yl)amino]benzoic acid IUPAC Name: 3-[(4,6-diphenoxy-1,3,5-triazin-2-yl)amino]benzoic acid Traditional Name: 3-[(4,6-diphenoxy-s-triazin-2-yl)amino]benzoic acid Formula: C22H16N4O4 MolecularWeight: 400.38684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=NC(=NC(=N2)NC3=CC=CC(=C3)C(=O)O)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)OC2=NC(=NC(=N2)NC3=CC=CC(=C3)C(=O)O)OC4=CC=CC=C4

InChI

InChI=1S/C22H16N4O4/c27-19(28)15-8-7-9-16(14-15)23-20-24-21(29-17-10-3-1-4-11-17)26-22(25-20)30-18-12-5-2-6-13-18/h1-14H,(H,27,28)(H,23,24,25,26)