zinc 2,7,12-triethyl-3,8,13,18-tetramethyl-17-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)porphyrin-23,24-diide

Systemtic Name: zinc 2,7,12-triethyl-3,8,13,18-tetramethyl-17-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)porphyrin-23,24-diide Openeye Name: zinc 2,7,12-triethyl-3,8,13,18-tetramethyl-17-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)porphyrin-23,24-diide CAS Name: zinc 2,7,12-triethyl-3,8,13,18-tetramethyl-17-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)porphyrin-23,24-diide IUPAC Name: zinc 2,7,12-triethyl-3,8,13,18-tetramethyl-17-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)porphyrin-23,24-diide Traditional Name: zinc 2,7,12-triethyl-3,8,13,18-tetramethyl-17-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)porphine-23,24-diide Formula: C36H43BN4O2Zn MolecularWeight: 639.97222

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Descriptors Computed from Structure

Canonical SMILES:

B1(OC(C(O1)(C)C)(C)C)C2=C(C3=CC4=NC(=CC5=NC(=CC6=C(C(=C([N-]6)C=C2[N-]3)C)CC)C(=C5CC)C)C(=C4CC)C)C.[Zn+2]

Isomeric SMILES

B1(OC(C(O1)(C)C)(C)C)C2=C(C3=CC4=NC(=CC5=NC(=CC6=C(C(=C([N-]6)C=C2[N-]3)C)CC)C(=C5CC)C)C(=C4CC)C)C.[Zn+2]

InChI

InChI=1S/C36H43BN4O2.Zn/c1-12-23-19(4)26-16-31-25(14-3)21(6)28(40-31)18-33-34(37-42-35(8,9)36(10,11)43-37)22(7)29(41-33)17-32-24(13-2)20(5)27(39-32)15-30(23)38-26;/h15-18H,12-14H2,1-11H3;/q-2;+2