N-[4-(10,20-diphenyl-23,24-dihydroporphyrin-5-yl)phenyl]-4-iodanyl-benzamide

Systemtic Name: N-[4-(10,20-diphenyl-23,24-dihydroporphyrin-5-yl)phenyl]-4-iodanyl-benzamide Openeye Name: N-[4-(10,20-diphenyl-23,24-dihydroporphyrin-5-yl)phenyl]-4-iodo-benzamide CAS Name: N-[4-(10,20-diphenyl-23,24-dihydroporphyrin-5-yl)phenyl]-4-iodobenzamide IUPAC Name: N-[4-(10,20-diphenyl-23,24-dihydroporphyrin-5-yl)phenyl]-4-iodobenzamide Traditional Name: N-[4-(10,20-diphenyl-23,24-dihydroporphin-5-yl)phenyl]-4-iodo-benzamide Formula: C45H30IN5O MolecularWeight: 783.65707

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=CC4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)NC(=O)C8=CC=C(C=C8)I)C9=CC=CC=C9)N3

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=CC4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)NC(=O)C8=CC=C(C=C8)I)C9=CC=CC=C9)N3

InChI

InChI=1S/C45H30IN5O/c46-32-15-11-31(12-16-32)45(52)49-33-17-13-30(14-18-33)44-40-25-23-38(50-40)42(28-7-3-1-4-8-28)36-21-19-34(47-36)27-35-20-22-37(48-35)43(29-9-5-2-6-10-29)39-24-26-41(44)51-39/h1-27,47-48H,(H,49,52)