22,23-dihydroporphyrin-2,3,5,7-tetrasulfonic acid

Systemtic Name: 22,23-dihydroporphyrin-2,3,5,7-tetrasulfonic acid Openeye Name: 22,23-dihydroporphyrin-2,3,5,7-tetrasulfonic acid CAS Name: 22,23-dihydroporphyrin-2,3,5,7-tetrasulfonic acid IUPAC Name: 22,23-dihydroporphyrin-2,3,5,7-tetrasulfonic acid Traditional Name: 22,23-dihydroporphine-2,3,5,7-tetrasulfonic acid Formula: C20H14N4O12S4 MolecularWeight: 630.60476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC3=CC(=C(N3)C(=C4C(=C(C(=N4)C=C5C=CC(=N5)C=C1N2)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC2=CC3=CC(=C(N3)C(=C4C(=C(C(=N4)C=C5C=CC(=N5)C=C1N2)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C20H14N4O12S4/c25-37(26,27)15-8-13-6-11-2-1-9(21-11)5-10-3-4-12(22-10)7-14-18(38(28,29)30)20(40(34,35)36)17(24-14)19(16(15)23-13)39(31,32)33/h1-8,21,23H,(H,25,26,27)(H,28,29,30)(H,31,32,33)(H,34,35,36)