2-[10,15,20-tris(2-sulfamoylphenyl)-21,24-dihydroporphyrin-5-yl]benzenesulfonamide

Systemtic Name: 2-[10,15,20-tris(2-sulfamoylphenyl)-21,24-dihydroporphyrin-5-yl]benzenesulfonamide Openeye Name: 2-[10,15,20-tris(2-sulfamoylphenyl)-21,24-dihydroporphyrin-5-yl]benzenesulfonamide CAS Name: 2-[10,15,20-tris(2-sulfamoylphenyl)-21,24-dihydroporphyrin-5-yl]benzenesulfonamide IUPAC Name: 2-[10,15,20-tris(2-sulfamoylphenyl)-21,24-dihydroporphyrin-5-yl]benzenesulfonamide Traditional Name: 2-[10,15,20-tris(2-sulfamoylphenyl)-21,24-dihydroporphin-5-yl]benzenesulfonamide Formula: C44H34N8O8S4 MolecularWeight: 931.04956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CC=C7S(=O)(=O)N)C8=CC=CC=C8S(=O)(=O)N)C9=CC=CC=C9S(=O)(=O)N)N3)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C(=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CC=C7S(=O)(=O)N)C8=CC=CC=C8S(=O)(=O)N)C9=CC=CC=C9S(=O)(=O)N)N3)S(=O)(=O)N

InChI

InChI=1S/C44H34N8O8S4/c45-61(53,54)37-13-5-1-9-25(37)41-29-17-19-31(49-29)42(26-10-2-6-14-38(26)62(46,55)56)33-21-23-35(51-33)44(28-12-4-8-16-40(28)64(48,59)60)36-24-22-34(52-36)43(32-20-18-30(41)50-32)27-11-3-7-15-39(27)63(47,57)58/h1-24,49-50H,(H2,45,53,54)(H2,46,55,56)(H2,47,57,58)(H2,48,59,60)