1-[2-oxidanylidene-2-[(4-phenoxyphenyl)amino]ethyl]-1,2,3-triazole-4,5-dicarboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-[(4-phenoxyphenyl)amino]ethyl]-1,2,3-triazole-4,5-dicarboxylic acid Openeye Name: 1-[2-oxo-2-(4-phenoxyanilino)ethyl]triazole-4,5-dicarboxylic acid CAS Name: 1-[2-oxo-2-(4-phenoxyanilino)ethyl]triazole-4,5-dicarboxylic acid IUPAC Name: 1-[2-oxo-2-(4-phenoxyanilino)ethyl]triazole-4,5-dicarboxylic acid Traditional Name: 1-[2-keto-2-(4-phenoxyanilino)ethyl]triazole-4,5-dicarboxylic acid Formula: C18H14N4O6 MolecularWeight: 382.32696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CN3C(=C(N=N3)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CN3C(=C(N=N3)C(=O)O)C(=O)O

InChI

InChI=1S/C18H14N4O6/c23-14(10-22-16(18(26)27)15(17(24)25)20-21-22)19-11-6-8-13(9-7-11)28-12-4-2-1-3-5-12/h1-9H,10H2,(H,19,23)(H,24,25)(H,26,27)