22,23-dihydro-3H-porphyrin-2-one; iron(3+)

Systemtic Name: 22,23-dihydro-3H-porphyrin-2-one; iron(3+) Openeye Name: ferric 22,23-dihydro-3H-porphyrin-2-one CAS Name: 22,23-dihydro-3H-porphyrin-2-one; iron(3+) IUPAC Name: 22,23-dihydro-3H-porphyrin-2-one; iron(3+) Traditional Name: ferric 22,23-dihydro-3H-porphin-2-one Formula: C20H14FeN4O+3 MolecularWeight: 382.19636

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC3=CC=C(N3)C=C4C=CC(=CC5=NC(=CC(=N2)C1=O)C=C5)N4.[Fe+3]

Isomeric SMILES

C1C2=CC3=CC=C(N3)C=C4C=CC(=CC5=NC(=CC(=N2)C1=O)C=C5)N4.[Fe+3]

InChI

InChI=1S/C20H14N4O.Fe/c25-20-11-18-9-16-4-3-14(22-16)7-12-1-2-13(21-12)8-15-5-6-17(23-15)10-19(20)24-18;/h1-10,21-22H,11H2;/q;+3