iron(2+); 2,17,18,20-tetramethyl-21,22-dihydroporphyrin

Systemtic Name: iron(2+); 2,17,18,20-tetramethyl-21,22-dihydroporphyrin Openeye Name: ferrous 2,17,18,20-tetramethyl-21,22-dihydroporphyrin CAS Name: iron(2+); 2,17,18,20-tetramethyl-21,22-dihydroporphyrin IUPAC Name: iron(2+); 2,17,18,20-tetramethyl-21,22-dihydroporphyrin Traditional Name: ferrous 2,17,18,20-tetramethyl-21,22-dihydroporphine Formula: C24H22FeN4+2 MolecularWeight: 422.30328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C3C(=C(C(=N3)C=C4C=CC(=N4)C=C5C=CC(=CC(=C1)N2)N5)C)C)C.[Fe+2]

Isomeric SMILES

CC1=C2C(=C3C(=C(C(=N3)C=C4C=CC(=N4)C=C5C=CC(=CC(=C1)N2)N5)C)C)C.[Fe+2]

InChI

InChI=1S/C24H22N4.Fe/c1-13-9-21-11-19-6-5-17(25-19)10-18-7-8-20(26-18)12-22-14(2)15(3)24(28-22)16(4)23(13)27-21;/h5-12,25,27H,1-4H3;/q;+2