5,10,15,20-tetrakis(1-methylpyridin-4-ylidene)-21,22,23,24-tetrahydroporphyrin

Systemtic Name: 5,10,15,20-tetrakis(1-methylpyridin-4-ylidene)-21,22,23,24-tetrahydroporphyrin Openeye Name: 5,10,15,20-tetrakis(1-methyl-4-pyridylidene)-21,22,23,24-tetrahydroporphyrin CAS Name: 5,10,15,20-tetrakis(1-methyl-4-pyridinylidene)-21,22,23,24-tetrahydroporphyrin IUPAC Name: 5,10,15,20-tetrakis(1-methylpyridin-4-ylidene)-21,22,23,24-tetrahydroporphyrin Traditional Name: 5,10,15,20-tetrakis(1-methyl-4-pyridylidene)-21,22,23,24-tetrahydroporphine Formula: C44H40N8 MolecularWeight: 680.842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C2C3=CC=C(N3)C(=C4C=CN(C=C4)C)C5=CC=C(N5)C(=C6C=CN(C=C6)C)C7=CC=C(N7)C(=C8C=CN(C=C8)C)C9=CC=C2N9)C=C1

Isomeric SMILES

CN1C=CC(=C2C3=CC=C(N3)C(=C4C=CN(C=C4)C)C5=CC=C(N5)C(=C6C=CN(C=C6)C)C7=CC=C(N7)C(=C8C=CN(C=C8)C)C9=CC=C2N9)C=C1

InChI

InChI=1S/C44H40N8/c1-49-21-13-29(14-22-49)41-33-5-7-35(45-33)42(30-15-23-50(2)24-16-30)37-9-11-39(47-37)44(32-19-27-52(4)28-20-32)40-12-10-38(48-40)43(36-8-6-34(41)46-36)31-17-25-51(3)26-18-31/h5-28,45-48H,1-4H3