diethyl 10,15-bis(trifluoromethyl)-22,24-dihydroporphyrin-2,3-dicarboxylate

Systemtic Name: diethyl 10,15-bis(trifluoromethyl)-22,24-dihydroporphyrin-2,3-dicarboxylate Openeye Name: diethyl 10,15-bis(trifluoromethyl)-22,24-dihydroporphyrin-2,3-dicarboxylate CAS Name: 10,15-bis(trifluoromethyl)-22,24-dihydroporphyrin-2,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 10,15-bis(trifluoromethyl)-22,24-dihydroporphyrin-2,3-dicarboxylate Traditional Name: 10,15-bis(trifluoromethyl)-22,24-dihydroporphine-2,3-dicarboxylic acid diethyl ester Formula: C28H20F6N4O4 MolecularWeight: 590.473219

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=NC1=CC3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC(=C2)N5)C(F)(F)F)C(F)(F)F)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(C2=NC1=CC3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC(=C2)N5)C(F)(F)F)C(F)(F)F)C(=O)OCC

InChI

InChI=1S/C28H20F6N4O4/c1-3-41-25(39)21-19-11-13-5-7-15(35-13)23(27(29,30)31)17-9-10-18(37-17)24(28(32,33)34)16-8-6-14(36-16)12-20(38-19)22(21)26(40)42-4-2/h5-12,35-36H,3-4H2,1-2H3