4-[15-(4-carbamimidoylphenyl)-10,20-bis(3-iodanylphenyl)-21,24-dihydroporphyrin-5-yl]benzenecarboximidamide

Systemtic Name: 4-[15-(4-carbamimidoylphenyl)-10,20-bis(3-iodanylphenyl)-21,24-dihydroporphyrin-5-yl]benzenecarboximidamide Openeye Name: 4-[15-(4-carbamimidoylphenyl)-10,20-bis(3-iodophenyl)-21,24-dihydroporphyrin-5-yl]benzamidine CAS Name: 4-[15-(4-carbamimidoylphenyl)-10,20-bis(3-iodophenyl)-21,24-dihydroporphyrin-5-yl]benzenecarboximidamide IUPAC Name: 4-[15-(4-carbamimidoylphenyl)-10,20-bis(3-iodophenyl)-21,24-dihydroporphyrin-5-yl]benzenecarboximidamide Traditional Name: 4-[15-(4-amidinophenyl)-10,20-bis(3-iodophenyl)-21,24-dihydroporphin-5-yl]benzamidine Formula: C46H32I2N8 MolecularWeight: 950.60882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2N6)C7=CC=C(C=C7)C(=N)N)C=C5)C8=CC(=CC=C8)I)C=C4)C9=CC=C(C=C9)C(=N)N)N3

Isomeric SMILES

C1=CC(=CC(=C1)I)C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2N6)C7=CC=C(C=C7)C(=N)N)C=C5)C8=CC(=CC=C8)I)C=C4)C9=CC=C(C=C9)C(=N)N)N3

InChI

InChI=1S/C46H32I2N8/c47-31-5-1-3-29(23-31)43-37-19-15-33(53-37)41(25-7-11-27(12-8-25)45(49)50)35-17-21-39(55-35)44(30-4-2-6-32(48)24-30)40-22-18-36(56-40)42(34-16-20-38(43)54-34)26-9-13-28(14-10-26)46(51)52/h1-24,53-54H,(H3,49,50)(H3,51,52)