3-nitro-5,10,15,20-tetraphenyl-22,23-dihydroporphyrin-2-amine

Systemtic Name: 3-nitro-5,10,15,20-tetraphenyl-22,23-dihydroporphyrin-2-amine Openeye Name: 3-nitro-5,10,15,20-tetraphenyl-22,23-dihydroporphyrin-2-amine CAS Name: 3-nitro-5,10,15,20-tetraphenyl-22,23-dihydroporphyrin-2-amine IUPAC Name: 3-nitro-5,10,15,20-tetraphenyl-22,23-dihydroporphyrin-2-amine Traditional Name: (3-nitro-5,10,15,20-tetraphenyl-22,23-dihydroporphin-2-yl)amine Formula: C44H30N6O2 MolecularWeight: 674.748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C(=C(C(=N5)C(=C6C=CC2=N6)C7=CC=CC=C7)N)[N+](=O)[O-])C8=CC=CC=C8)C9=CC=CC=C9)N3

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C(=C(C(=N5)C(=C6C=CC2=N6)C7=CC=CC=C7)N)[N+](=O)[O-])C8=CC=CC=C8)C9=CC=CC=C9)N3

InChI

InChI=1S/C44H30N6O2/c45-41-42-39(29-17-9-3-10-18-29)35-25-23-33(47-35)37(27-13-5-1-6-14-27)31-21-22-32(46-31)38(28-15-7-2-8-16-28)34-24-26-36(48-34)40(30-19-11-4-12-20-30)43(49-42)44(41)50(51)52/h1-26,46,48H,45H2