2-deuterio-5,10,15,20-tetraphenyl-2,3,22,24-tetrahydroporphyrin

Systemtic Name: 2-deuterio-5,10,15,20-tetraphenyl-2,3,22,24-tetrahydroporphyrin Openeye Name: 2-deuterio-5,10,15,20-tetraphenyl-2,3,22,24-tetrahydroporphyrin CAS Name: 2-deuterio-5,10,15,20-tetraphenyl-2,3,22,24-tetrahydroporphyrin IUPAC Name: 2-deuterio-5,10,15,20-tetraphenyl-2,3,22,24-tetrahydroporphyrin Traditional Name: 2-deuterio-5,10,15,20-tetraphenyl-2,3,22,24-tetrahydroporphine Formula: C44H32N4 MolecularWeight: 617.757842

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC1=C(C3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC(=C2C6=CC=CC=C6)N5)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9

Isomeric SMILES

[2H]C1CC2=NC1=C(C3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC(=C2C6=CC=CC=C6)N5)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9

InChI

InChI=1S/C44H32N4/c1-5-13-29(14-6-1)41-33-21-23-35(45-33)42(30-15-7-2-8-16-30)37-25-27-39(47-37)44(32-19-11-4-12-20-32)40-28-26-38(48-40)43(31-17-9-3-10-18-31)36-24-22-34(41)46-36/h1-25,27,46-47H,26,28H2/i26D