zinc 2,7,12-triethyl-3,8,13,18-tetramethyl-17-phenyl-porphyrin-22,24-diide

Systemtic Name: zinc 2,7,12-triethyl-3,8,13,18-tetramethyl-17-phenyl-porphyrin-22,24-diide Openeye Name: zinc 2,7,12-triethyl-3,8,13,18-tetramethyl-17-phenyl-porphyrin-22,24-diide CAS Name: zinc 2,7,12-triethyl-3,8,13,18-tetramethyl-17-phenylporphyrin-22,24-diide IUPAC Name: zinc 2,7,12-triethyl-3,8,13,18-tetramethyl-17-phenylporphyrin-22,24-diide Traditional Name: zinc 2,7,12-triethyl-3,8,13,18-tetramethyl-17-phenyl-porphine-22,24-diide Formula: C36H36N4Zn MolecularWeight: 590.10684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC3=C(C(=C([N-]3)C=C4C(=C(C(=N4)C=C5C(=C(C(=CC1=N2)[N-]5)C)C6=CC=CC=C6)C)CC)C)CC)C.[Zn+2]

Isomeric SMILES

CCC1=C(C2=CC3=C(C(=C([N-]3)C=C4C(=C(C(=N4)C=C5C(=C(C(=CC1=N2)[N-]5)C)C6=CC=CC=C6)C)CC)C)CC)C.[Zn+2]

InChI

InChI=1S/C36H36N4.Zn/c1-8-25-20(4)28-17-33-27(10-3)22(6)30(39-33)19-35-36(24-14-12-11-13-15-24)23(7)31(40-35)18-34-26(9-2)21(5)29(38-34)16-32(25)37-28;/h11-19H,8-10H2,1-7H3;/q-2;+2