1,1,2-tris(fluoranyl)ethyl 23,24-dihydroporphyrin-5-carboxylate

Systemtic Name: 1,1,2-tris(fluoranyl)ethyl 23,24-dihydroporphyrin-5-carboxylate Openeye Name: 1,1,2-trifluoroethyl 23,24-dihydroporphyrin-5-carboxylate CAS Name: 23,24-dihydroporphyrin-5-carboxylic acid 1,1,2-trifluoroethyl ester IUPAC Name: 1,1,2-trifluoroethyl 23,24-dihydroporphyrin-5-carboxylate Traditional Name: 23,24-dihydroporphine-5-carboxylic acid 1,1,2-trifluoroethyl ester Formula: C23H15F3N4O2 MolecularWeight: 436.38601

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC3=CC=C(N3)C=C4C=CC(=N4)C(=C5C=CC(=N5)C=C1N2)C(=O)OC(CF)(F)F

Isomeric SMILES

C1=CC2=CC3=CC=C(N3)C=C4C=CC(=N4)C(=C5C=CC(=N5)C=C1N2)C(=O)OC(CF)(F)F

InChI

InChI=1S/C23H15F3N4O2/c24-12-23(25,26)32-22(31)21-19-7-5-17(29-19)10-15-3-1-13(27-15)9-14-2-4-16(28-14)11-18-6-8-20(21)30-18/h1-11,27-28H,12H2