copper 3,3-dimethyl-10,15-bis[2,3,4,5,6-pentakis(fluoranyl)phenyl]-2H-porphyrin-22,23-diide

Systemtic Name: copper 3,3-dimethyl-10,15-bis[2,3,4,5,6-pentakis(fluoranyl)phenyl]-2H-porphyrin-22,23-diide Openeye Name: copper 3,3-dimethyl-10,15-bis(2,3,4,5,6-pentafluorophenyl)-2H-porphyrin-22,23-diide CAS Name: copper 3,3-dimethyl-10,15-bis(2,3,4,5,6-pentafluorophenyl)-2H-porphyrin-22,23-diide IUPAC Name: copper 3,3-dimethyl-10,15-bis(2,3,4,5,6-pentafluorophenyl)-2H-porphyrin-22,23-diide Traditional Name: cupric 3,3-dimethyl-10,15-bis(2,3,4,5,6-pentafluorophenyl)-2H-porphine-22,23-diide Formula: C34H16CuF10N4 MolecularWeight: 734.047672

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC3=NC(=C(C4=CC=C([N-]4)C(=C5C=CC(=CC1=N2)[N-]5)C6=C(C(=C(C(=C6F)F)F)F)F)C7=C(C(=C(C(=C7F)F)F)F)F)C=C3)C.[Cu+2]

Isomeric SMILES

CC1(CC2=CC3=NC(=C(C4=CC=C([N-]4)C(=C5C=CC(=CC1=N2)[N-]5)C6=C(C(=C(C(=C6F)F)F)F)F)C7=C(C(=C(C(=C7F)F)F)F)F)C=C3)C.[Cu+2]

InChI

InChI=1S/C34H16F10N4.Cu/c1-34(2)11-14-9-12-3-5-15(45-12)20(22-24(35)28(39)32(43)29(40)25(22)36)17-7-8-18(48-17)21(16-6-4-13(46-16)10-19(34)47-14)23-26(37)30(41)33(44)31(42)27(23)38;/h3-10H,11H2,1-2H3;/q-2;+2