5,10,15,20-tetrakis(2-methylphenyl)-21,22-dihydroporphyrin

Systemtic Name: 5,10,15,20-tetrakis(2-methylphenyl)-21,22-dihydroporphyrin Openeye Name: 5,10,15,20-tetrakis(o-tolyl)-21,22-dihydroporphyrin CAS Name: 5,10,15,20-tetrakis(2-methylphenyl)-21,22-dihydroporphyrin IUPAC Name: 5,10,15,20-tetrakis(2-methylphenyl)-21,22-dihydroporphyrin Traditional Name: 5,10,15,20-tetrakis(o-tolyl)-21,22-dihydroporphine Formula: C48H38N4 MolecularWeight: 670.84212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CC=C7C)C8=CC=CC=C8C)C9=CC=CC=C9C)N3

Isomeric SMILES

CC1=CC=CC=C1C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CC=C7C)C8=CC=CC=C8C)C9=CC=CC=C9C)N3

InChI

InChI=1S/C48H38N4/c1-29-13-5-9-17-33(29)45-37-21-23-39(49-37)46(34-18-10-6-14-30(34)2)41-25-27-43(51-41)48(36-20-12-8-16-32(36)4)44-28-26-42(52-44)47(40-24-22-38(45)50-40)35-19-11-7-15-31(35)3/h5-28,49-50H,1-4H3