15,17,18,20-tetraphenyl-22,23-dihydroporphyrin-2,3-disulfonate

Systemtic Name: 15,17,18,20-tetraphenyl-22,23-dihydroporphyrin-2,3-disulfonate Openeye Name: 15,17,18,20-tetraphenyl-22,23-dihydroporphyrin-2,3-disulfonate CAS Name: 15,17,18,20-tetraphenyl-22,23-dihydroporphyrin-2,3-disulfonate IUPAC Name: 15,17,18,20-tetraphenyl-22,23-dihydroporphyrin-2,3-disulfonate Traditional Name: 15,17,18,20-tetraphenyl-22,23-dihydroporphine-2,3-disulfonate Formula: C44H28N4O6S2-2 MolecularWeight: 772.84632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C(=C(C(=N3)C(=C4C(=C(C(=N4)C=C5C=CC(=CC6=CC=C2N6)N5)S(=O)(=O)[O-])S(=O)(=O)[O-])C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C(=C(C(=N3)C(=C4C(=C(C(=N4)C=C5C=CC(=CC6=CC=C2N6)N5)S(=O)(=O)[O-])S(=O)(=O)[O-])C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9

InChI

InChI=1S/C44H30N4O6S2/c49-55(50,51)43-35-26-33-22-21-31(45-33)25-32-23-24-34(46-32)36(27-13-5-1-6-14-27)40-37(28-15-7-2-8-16-28)38(29-17-9-3-10-18-29)41(48-40)39(30-19-11-4-12-20-30)42(47-35)44(43)56(52,53)54/h1-26,45-46H,(H,49,50,51)(H,52,53,54)/p-2