21,22-dihydroporphyrin; gadolinium(3+)

Systemtic Name: 21,22-dihydroporphyrin; gadolinium(3+) Openeye Name: 21,22-dihydroporphyrin; gadolinium(3+) CAS Name: 21,22-dihydroporphyrin; gadolinium(3+) IUPAC Name: 21,22-dihydroporphyrin; gadolinium(3+) Traditional Name: 21,22-dihydroporphine; gadolinium(3+) Formula: C20H14GdN4+3 MolecularWeight: 467.60196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC3=CC=C(N3)C=C4C=CC(=N4)C=C5C=CC(=N5)C=C1N2.[Gd+3]

Isomeric SMILES

C1=CC2=CC3=CC=C(N3)C=C4C=CC(=N4)C=C5C=CC(=N5)C=C1N2.[Gd+3]

InChI

InChI=1S/C20H14N4.Gd/c1-2-14-10-16-5-6-18(23-16)12-20-8-7-19(24-20)11-17-4-3-15(22-17)9-13(1)21-14;/h1-12,21-22H;/q;+3