N5,N15-bis(4-nitrophenyl)-10,20-diphenyl-21,24-dihydroporphyrin-5,15-diamine

Systemtic Name: N5,N15-bis(4-nitrophenyl)-10,20-diphenyl-21,24-dihydroporphyrin-5,15-diamine Openeye Name: N5,N15-bis(4-nitrophenyl)-10,20-diphenyl-21,24-dihydroporphyrin-5,15-diamine CAS Name: N5,N15-bis(4-nitrophenyl)-10,20-diphenyl-21,24-dihydroporphyrin-5,15-diamine IUPAC Name: 5-N,15-N-bis(4-nitrophenyl)-10,20-diphenyl-21,24-dihydroporphyrin-5,15-diamine Traditional Name: [15-(4-nitroanilino)-10,20-diphenyl-21,24-dihydroporphin-5-yl]-(4-nitrophenyl)amine Formula: C44H30N8O4 MolecularWeight: 734.7602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2N6)NC7=CC=C(C=C7)[N+](=O)[O-])C=C5)C8=CC=CC=C8)C=C4)NC9=CC=C(C=C9)[N+](=O)[O-])N3

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2N6)NC7=CC=C(C=C7)[N+](=O)[O-])C=C5)C8=CC=CC=C8)C=C4)NC9=CC=C(C=C9)[N+](=O)[O-])N3

InChI

InChI=1S/C44H30N8O4/c53-51(54)31-15-11-29(12-16-31)45-43-37-23-19-33(47-37)41(27-7-3-1-4-8-27)34-20-24-38(48-34)44(46-30-13-17-32(18-14-30)52(55)56)40-26-22-36(50-40)42(28-9-5-2-6-10-28)35-21-25-39(43)49-35/h1-26,45-48H