15-bromanyl-5-(4-nitrophenoxy)-10,20-diphenyl-21,22-dihydroporphyrin

Systemtic Name: 15-bromanyl-5-(4-nitrophenoxy)-10,20-diphenyl-21,22-dihydroporphyrin Openeye Name: 15-bromo-5-(4-nitrophenoxy)-10,20-diphenyl-21,22-dihydroporphyrin CAS Name: 15-bromo-5-(4-nitrophenoxy)-10,20-diphenyl-21,22-dihydroporphyrin IUPAC Name: 15-bromo-5-(4-nitrophenoxy)-10,20-diphenyl-21,22-dihydroporphyrin Traditional Name: 15-bromo-5-(4-nitrophenoxy)-10,20-diphenyl-21,22-dihydroporphine Formula: C38H24BrN5O3 MolecularWeight: 678.53286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)Br)C7=CC=CC=C7)OC8=CC=C(C=C8)[N+](=O)[O-])N3

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)Br)C7=CC=CC=C7)OC8=CC=C(C=C8)[N+](=O)[O-])N3

InChI

InChI=1S/C38H24BrN5O3/c39-37-31-19-15-27(40-31)35(23-7-3-1-4-8-23)29-17-21-33(42-29)38(47-26-13-11-25(12-14-26)44(45)46)34-22-18-30(43-34)36(24-9-5-2-6-10-24)28-16-20-32(37)41-28/h1-22,42-43H