5,15-diphenyl-10-piperidin-1-yl-porphyrin-22,23-diide; nickel(2+)

Systemtic Name: 5,15-diphenyl-10-piperidin-1-yl-porphyrin-22,23-diide; nickel(2+) Openeye Name: nickelous 5,15-diphenyl-10-(1-piperidyl)porphyrin-22,23-diide CAS Name: 5,15-diphenyl-10-(1-piperidinyl)porphyrin-22,23-diide; nickel(2+) IUPAC Name: 5,15-diphenyl-10-piperidin-1-ylporphyrin-22,23-diide; nickel(2+) Traditional Name: nickelous 5,15-diphenyl-10-piperidino-porphine-22,23-diide Formula: C37H29N5Ni MolecularWeight: 602.35306

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C=CC(=C(C4=NC(=CC5=NC(=C(C6=CC=C2[N-]6)C7=CC=CC=C7)C=C5)C=C4)C8=CC=CC=C8)[N-]3.[Ni+2]

Isomeric SMILES

C1CCN(CC1)C2=C3C=CC(=C(C4=NC(=CC5=NC(=C(C6=CC=C2[N-]6)C7=CC=CC=C7)C=C5)C=C4)C8=CC=CC=C8)[N-]3.[Ni+2]

InChI

InChI=1S/C37H29N5.Ni/c1-4-10-25(11-5-1)35-29-16-14-27(38-29)24-28-15-17-30(39-28)36(26-12-6-2-7-13-26)32-19-21-34(41-32)37(33-20-18-31(35)40-33)42-22-8-3-9-23-42;/h1-2,4-7,10-21,24H,3,8-9,22-23H2;/q-2;+2