4-bromanyl-3-[10,15,20-tris(2-bromanyl-5-oxidanyl-phenyl)-21,24-dihydroporphyrin-5-yl]phenol

Systemtic Name: 4-bromanyl-3-[10,15,20-tris(2-bromanyl-5-oxidanyl-phenyl)-21,24-dihydroporphyrin-5-yl]phenol Openeye Name: 4-bromo-3-[10,15,20-tris(2-bromo-5-hydroxy-phenyl)-21,24-dihydroporphyrin-5-yl]phenol CAS Name: 4-bromo-3-[10,15,20-tris(2-bromo-5-hydroxyphenyl)-21,24-dihydroporphyrin-5-yl]phenol IUPAC Name: 4-bromo-3-[10,15,20-tris(2-bromo-5-hydroxyphenyl)-21,24-dihydroporphyrin-5-yl]phenol Traditional Name: 4-bromo-3-[10,15,20-tris(2-bromo-5-hydroxy-phenyl)-21,24-dihydroporphin-5-yl]phenol Formula: C44H26Br4N4O4 MolecularWeight: 994.31764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1O)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=C(C=CC(=C7)O)Br)C8=C(C=CC(=C8)O)Br)C9=C(C=CC(=C9)O)Br)N3)Br

Isomeric SMILES

C1=CC(=C(C=C1O)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=C(C=CC(=C7)O)Br)C8=C(C=CC(=C8)O)Br)C9=C(C=CC(=C9)O)Br)N3)Br

InChI

InChI=1S/C44H26Br4N4O4/c45-29-5-1-21(53)17-25(29)41-33-9-11-35(49-33)42(26-18-22(54)2-6-30(26)46)37-13-15-39(51-37)44(28-20-24(56)4-8-32(28)48)40-16-14-38(52-40)43(36-12-10-34(41)50-36)27-19-23(55)3-7-31(27)47/h1-20,49-50,53-56H