2-[2,3,4,5,6-pentakis(fluoranyl)phenyl]-21,22-dihydroporphyrin

Systemtic Name: 2-[2,3,4,5,6-pentakis(fluoranyl)phenyl]-21,22-dihydroporphyrin Openeye Name: 2-(2,3,4,5,6-pentafluorophenyl)-21,22-dihydroporphyrin CAS Name: 2-(2,3,4,5,6-pentafluorophenyl)-21,22-dihydroporphyrin IUPAC Name: 2-(2,3,4,5,6-pentafluorophenyl)-21,22-dihydroporphyrin Traditional Name: 2-(2,3,4,5,6-pentafluorophenyl)-21,22-dihydroporphine Formula: C26H13F5N4 MolecularWeight: 476.400236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC3=CC(=C(N3)C=C4C=CC(=N4)C=C5C=CC(=N5)C=C1N2)C6=C(C(=C(C(=C6F)F)F)F)F

Isomeric SMILES

C1=CC2=CC3=CC(=C(N3)C=C4C=CC(=N4)C=C5C=CC(=N5)C=C1N2)C6=C(C(=C(C(=C6F)F)F)F)F

InChI

InChI=1S/C26H13F5N4/c27-22-21(23(28)25(30)26(31)24(22)29)19-10-18-9-16-4-3-14(33-16)7-12-1-2-13(32-12)8-15-5-6-17(34-15)11-20(19)35-18/h1-11,33,35H