2,7,12,17-tetrakis(phenylmethyl)-21,22-dihydroporphyrin

Systemtic Name: 2,7,12,17-tetrakis(phenylmethyl)-21,22-dihydroporphyrin Openeye Name: 2,7,12,17-tetrabenzyl-21,22-dihydroporphyrin CAS Name: 2,7,12,17-tetrakis(phenylmethyl)-21,22-dihydroporphyrin IUPAC Name: 2,7,12,17-tetrabenzyl-21,22-dihydroporphyrin Traditional Name: 2,7,12,17-tetrabenzyl-21,22-dihydroporphine Formula: C48H38N4 MolecularWeight: 670.84212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC3=CC4=C(C=C(N4)C=C5C(=CC(=N5)C=C6C(=CC(=N6)C=C2N3)CC7=CC=CC=C7)CC8=CC=CC=C8)CC9=CC=CC=C9

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC3=CC4=C(C=C(N4)C=C5C(=CC(=N5)C=C6C(=CC(=N6)C=C2N3)CC7=CC=CC=C7)CC8=CC=CC=C8)CC9=CC=CC=C9

InChI

InChI=1S/C48H38N4/c1-5-13-33(14-6-1)21-37-25-41-30-46-39(23-35-17-9-3-10-18-35)27-43(51-46)32-48-40(24-36-19-11-4-12-20-36)28-44(52-48)31-47-38(22-34-15-7-2-8-16-34)26-42(50-47)29-45(37)49-41/h1-20,25-32,49-50H,21-24H2