3-[17,18,20-tris(3-hydroxyphenyl)-21,22-dihydroporphyrin-2-yl]phenol

Systemtic Name: 3-[17,18,20-tris(3-hydroxyphenyl)-21,22-dihydroporphyrin-2-yl]phenol Openeye Name: 3-[17,18,20-tris(3-hydroxyphenyl)-21,22-dihydroporphyrin-2-yl]phenol CAS Name: 3-[17,18,20-tris(3-hydroxyphenyl)-21,22-dihydroporphyrin-2-yl]phenol IUPAC Name: 3-[17,18,20-tris(3-hydroxyphenyl)-21,22-dihydroporphyrin-2-yl]phenol Traditional Name: 3-[17,18,20-tris(3-hydroxyphenyl)-21,22-dihydroporphin-2-yl]phenol Formula: C44H30N4O4 MolecularWeight: 678.7334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)C2=C3C(=C4C(=C(C(=N4)C=C5C=CC(=N5)C=C6C=CC(=CC(=C2)N3)N6)C7=CC(=CC=C7)O)C8=CC(=CC=C8)O)C9=CC(=CC=C9)O

Isomeric SMILES

C1=CC(=CC(=C1)O)C2=C3C(=C4C(=C(C(=N4)C=C5C=CC(=N5)C=C6C=CC(=CC(=C2)N3)N6)C7=CC(=CC=C7)O)C8=CC(=CC=C8)O)C9=CC(=CC=C9)O

InChI

InChI=1S/C44H30N4O4/c49-34-9-1-5-25(17-34)38-23-33-22-31-14-13-29(45-31)21-30-15-16-32(46-30)24-39-40(26-6-2-10-35(50)18-26)41(27-7-3-11-36(51)19-27)44(48-39)42(43(38)47-33)28-8-4-12-37(52)20-28/h1-24,45,47,49-52H