5,10,15,20-tetraphenyl-2-propan-2-yl-21,22-dihydroporphyrin

Systemtic Name: 5,10,15,20-tetraphenyl-2-propan-2-yl-21,22-dihydroporphyrin Openeye Name: 2-isopropyl-5,10,15,20-tetraphenyl-21,22-dihydroporphyrin CAS Name: 5,10,15,20-tetraphenyl-2-propan-2-yl-21,22-dihydroporphyrin IUPAC Name: 5,10,15,20-tetraphenyl-2-propan-2-yl-21,22-dihydroporphyrin Traditional Name: 2-isopropyl-5,10,15,20-tetraphenyl-21,22-dihydroporphine Formula: C47H36N4 MolecularWeight: 656.81554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=C3C=CC(=N3)C(=C4C=CC(=N4)C(=C5C=CC(=C(C(=C1)N2)C6=CC=CC=C6)N5)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9

Isomeric SMILES

CC(C)C1=C2C(=C3C=CC(=N3)C(=C4C=CC(=N4)C(=C5C=CC(=C(C(=C1)N2)C6=CC=CC=C6)N5)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9

InChI

InChI=1S/C47H36N4/c1-30(2)35-29-42-45(33-19-11-5-12-20-33)40-26-25-38(49-40)43(31-15-7-3-8-16-31)36-23-24-37(48-36)44(32-17-9-4-10-18-32)39-27-28-41(50-39)46(47(35)51-42)34-21-13-6-14-22-34/h3-30,49,51H,1-2H3