4-[10,15,20-tris(4-aminocarbonylphenyl)-21,24-dihydroporphyrin-5-yl]benzamide

Systemtic Name: 4-[10,15,20-tris(4-aminocarbonylphenyl)-21,24-dihydroporphyrin-5-yl]benzamide Openeye Name: 4-[10,15,20-tris(4-carbamoylphenyl)-21,24-dihydroporphyrin-5-yl]benzamide CAS Name: 4-[10,15,20-tris(4-carbamoylphenyl)-21,24-dihydroporphyrin-5-yl]benzamide IUPAC Name: 4-[10,15,20-tris(4-carbamoylphenyl)-21,24-dihydroporphyrin-5-yl]benzamide Traditional Name: 4-[10,15,20-tris(4-carbamoylphenyl)-21,24-dihydroporphin-5-yl]benzamide Formula: C48H34N8O4 MolecularWeight: 786.83476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)C(=O)N)C8=CC=C(C=C8)C(=O)N)C9=CC=C(C=C9)C(=O)N)N3)C(=O)N

Isomeric SMILES

C1=CC(=CC=C1C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)C(=O)N)C8=CC=C(C=C8)C(=O)N)C9=CC=C(C=C9)C(=O)N)N3)C(=O)N

InChI

InChI=1S/C48H34N8O4/c49-45(57)29-9-1-25(2-10-29)41-33-17-19-35(53-33)42(26-3-11-30(12-4-26)46(50)58)37-21-23-39(55-37)44(28-7-15-32(16-8-28)48(52)60)40-24-22-38(56-40)43(36-20-18-34(41)54-36)27-5-13-31(14-6-27)47(51)59/h1-24,53-54H,(H2,49,57)(H2,50,58)(H2,51,59)(H2,52,60)