2-(21,22-dihydroporphyrin-2-yl)benzenesulfonic acid; manganese(2+)

Systemtic Name: 2-(21,22-dihydroporphyrin-2-yl)benzenesulfonic acid; manganese(2+) Openeye Name: manganous 2-(21,22-dihydroporphyrin-2-yl)benzenesulfonic acid CAS Name: 2-(21,22-dihydroporphyrin-2-yl)benzenesulfonic acid; manganese(2+) IUPAC Name: 2-(21,22-dihydroporphyrin-2-yl)benzenesulfonic acid; manganese(2+) Traditional Name: manganous 2-(21,22-dihydroporphin-2-yl)besylic acid Formula: C26H18MnN4O3S+2 MolecularWeight: 521.449169

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C3C=C4C=CC(=N4)C=C5C=CC(=N5)C=C6C=CC(=CC(=C2)N3)N6)S(=O)(=O)O.[Mn+2]

Isomeric SMILES

C1=CC=C(C(=C1)C2=C3C=C4C=CC(=N4)C=C5C=CC(=N5)C=C6C=CC(=CC(=C2)N3)N6)S(=O)(=O)O.[Mn+2]

InChI

InChI=1S/C26H18N4O3S.Mn/c31-34(32,33)26-4-2-1-3-23(26)24-14-22-13-20-8-7-18(28-20)11-16-5-6-17(27-16)12-19-9-10-21(29-19)15-25(24)30-22;/h1-15,28,30H,(H,31,32,33);/q;+2