zinc 2-[(1Z,5Z,9Z,14Z)-10,15-bis(2-hydroxyphenyl)-20-(2-oxidanidylphenyl)-4,11,21,22,23,24-hexahydroporphyrin-5-yl]phenolate

Systemtic Name: zinc 2-[(1Z,5Z,9Z,14Z)-10,15-bis(2-hydroxyphenyl)-20-(2-oxidanidylphenyl)-4,11,21,22,23,24-hexahydroporphyrin-5-yl]phenolate Openeye Name: zinc 2-[(1Z,5Z,9Z,14Z)-10,15-bis(2-hydroxyphenyl)-20-(2-oxidophenyl)-4,11,21,22,23,24-hexahydroporphyrin-5-yl]phenolate CAS Name: zinc 2-[(1Z,5Z,9Z,14Z)-10,15-bis(2-hydroxyphenyl)-20-(2-oxidophenyl)-4,11,21,22,23,24-hexahydroporphyrin-5-yl]phenolate IUPAC Name: zinc 2-[(1Z,5Z,9Z,14Z)-10,15-bis(2-hydroxyphenyl)-20-(2-oxidophenyl)-4,11,21,22,23,24-hexahydroporphyrin-5-yl]phenolate Traditional Name: zinc 2-[(1Z,5Z,9Z,14Z)-10,15-bis(2-hydroxyphenyl)-20-(2-oxidophenyl)-4,11,21,22,23,24-hexahydroporphin-5-yl]phenolate Formula: C44H32N4O4Zn MolecularWeight: 746.15828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C3C=CC(=C(C4C=CC(=C(C5=CC=C(N5)C(=C6C=CC2N6)C7=CC=CC=C7O)C8=CC=CC=C8[O-])N4)C9=CC=CC=C9[O-])N3)O.[Zn+2]

Isomeric SMILES

C1=CC=C(C(=C1)/C/2=C/3\C=C/C(=C(/C4C=C/C(=C(/C5=CC=C(N5)/C(=C\6/C=CC2N6)/C7=CC=CC=C7O)\C8=CC=CC=C8[O-])/N4)\C9=CC=CC=C9[O-])/N3)O.[Zn+2]

InChI

InChI=1S/C44H34N4O4.Zn/c49-37-13-5-1-9-25(37)41-29-17-19-31(45-29)42(26-10-2-6-14-38(26)50)33-21-23-35(47-33)44(28-12-4-8-16-40(28)52)36-24-22-34(48-36)43(32-20-18-30(41)46-32)27-11-3-7-15-39(27)51;/h1-24,29,34,45-52H;/q;+2/p-2/b41-30-,42-31-,43-32-,44-36-;