2,17,18,20-tetrakis(1-methyl-2H-quinolin-3-yl)-21,22-dihydroporphyrin

Systemtic Name: 2,17,18,20-tetrakis(1-methyl-2H-quinolin-3-yl)-21,22-dihydroporphyrin Openeye Name: 2,17,18,20-tetrakis(1-methyl-2H-quinolin-3-yl)-21,22-dihydroporphyrin CAS Name: 2,17,18,20-tetrakis(1-methyl-2H-quinolin-3-yl)-21,22-dihydroporphyrin IUPAC Name: 2,17,18,20-tetrakis(1-methyl-2H-quinolin-3-yl)-21,22-dihydroporphyrin Traditional Name: 2,17,18,20-tetrakis(1-methyl-2H-quinolin-3-yl)-21,22-dihydroporphine Formula: C60H50N8 MolecularWeight: 883.0926

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=CC2=CC=CC=C21)C3=C4C(=C5C(=C(C(=N5)C=C6C=CC(=N6)C=C7C=CC(=CC(=C3)N4)N7)C8=CC9=CC=CC=C9N(C8)C)C1=CC2=CC=CC=C2N(C1)C)C1=CC2=CC=CC=C2N(C1)C

Isomeric SMILES

CN1CC(=CC2=CC=CC=C21)C3=C4C(=C5C(=C(C(=N5)C=C6C=CC(=N6)C=C7C=CC(=CC(=C3)N4)N7)C8=CC9=CC=CC=C9N(C8)C)C1=CC2=CC=CC=C2N(C1)C)C1=CC2=CC=CC=C2N(C1)C

InChI

InChI=1S/C60H50N8/c1-65-33-41(25-37-13-5-9-17-52(37)65)50-31-49-30-47-22-21-45(61-47)29-46-23-24-48(62-46)32-51-56(42-26-38-14-6-10-18-53(38)66(2)34-42)57(43-27-39-15-7-11-19-54(39)67(3)35-43)60(64-51)58(59(50)63-49)44-28-40-16-8-12-20-55(40)68(4)36-44/h5-32,61,63H,33-36H2,1-4H3