10,20-bis(4-tert-butylphenyl)-15-phenyl-21,22-dihydroporphyrin

Systemtic Name: 10,20-bis(4-tert-butylphenyl)-15-phenyl-21,22-dihydroporphyrin Openeye Name: 10,20-bis(4-tert-butylphenyl)-15-phenyl-21,22-dihydroporphyrin CAS Name: 10,20-bis(4-tert-butylphenyl)-15-phenyl-21,22-dihydroporphyrin IUPAC Name: 10,20-bis(4-tert-butylphenyl)-15-phenyl-21,22-dihydroporphyrin Traditional Name: 10,20-bis(4-tert-butylphenyl)-15-phenyl-21,22-dihydroporphine Formula: C46H42N4 MolecularWeight: 650.85248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C3C=CC(=CC4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=C(C=C8)C(C)(C)C)N3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C3C=CC(=CC4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=C(C=C8)C(C)(C)C)N3

InChI

InChI=1S/C46H42N4/c1-45(2,3)32-16-12-30(13-17-32)43-36-22-20-34(47-36)28-35-21-23-37(48-35)44(31-14-18-33(19-15-31)46(4,5)6)41-27-25-39(50-41)42(29-10-8-7-9-11-29)38-24-26-40(43)49-38/h7-28,47-48H,1-6H3