2-[[4,6-bis[(2-carboxylatophenyl)amino]-1,3,5-triazin-2-yl]amino]benzoate

Systemtic Name: 2-[[4,6-bis[(2-carboxylatophenyl)amino]-1,3,5-triazin-2-yl]amino]benzoate Openeye Name: 2-[[4,6-bis(2-carboxylatoanilino)-1,3,5-triazin-2-yl]amino]benzoate CAS Name: 2-[[4,6-bis(2-carboxylatoanilino)-1,3,5-triazin-2-yl]amino]benzoate IUPAC Name: 2-[[4,6-bis(2-carboxylatoanilino)-1,3,5-triazin-2-yl]amino]benzoate Traditional Name: 2-[[4,6-bis(2-carboxylatoanilino)-s-triazin-2-yl]amino]benzoate Formula: C24H15N6O6-3 MolecularWeight: 483.4125

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])NC2=NC(=NC(=N2)NC3=CC=CC=C3C(=O)[O-])NC4=CC=CC=C4C(=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])NC2=NC(=NC(=N2)NC3=CC=CC=C3C(=O)[O-])NC4=CC=CC=C4C(=O)[O-]

InChI

InChI=1S/C24H18N6O6/c31-19(32)13-7-1-4-10-16(13)25-22-28-23(26-17-11-5-2-8-14(17)20(33)34)30-24(29-22)27-18-12-6-3-9-15(18)21(35)36/h1-12H,(H,31,32)(H,33,34)(H,35,36)(H3,25,26,27,28,29,30)/p-3