zinc 7,13-bis(2-methoxy-2-oxidanylidene-ethyl)-8,12-bis(3-methoxy-3-oxidanylidene-propyl)-3,3,17,18-tetramethyl-porphyrin-24-id-2-olate

Systemtic Name: zinc 7,13-bis(2-methoxy-2-oxidanylidene-ethyl)-8,12-bis(3-methoxy-3-oxidanylidene-propyl)-3,3,17,18-tetramethyl-porphyrin-24-id-2-olate Openeye Name: zinc 7,13-bis(2-methoxy-2-oxo-ethyl)-8,12-bis(3-methoxy-3-oxo-propyl)-3,3,17,18-tetramethyl-porphyrin-24-id-2-olate CAS Name: zinc 7,13-bis(2-methoxy-2-oxoethyl)-8,12-bis(3-methoxy-3-oxopropyl)-3,3,17,18-tetramethyl-2-porphyrin-24-idolate IUPAC Name: zinc 7,13-bis(2-methoxy-2-oxoethyl)-8,12-bis(3-methoxy-3-oxopropyl)-3,3,17,18-tetramethylporphyrin-24-id-2-olate Traditional Name: zinc 7,13-bis(2-keto-2-methoxy-ethyl)-8,12-bis(3-keto-3-methoxy-propyl)-3,3,17,18-tetramethyl-porphin-24-id-2-olate Formula: C38H40N4O9Zn MolecularWeight: 762.1546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC3=NC(=CC4=NC(=CC5=NC(=C(C5(C)C)[O-])C=C1[N-]2)C(=C4CCC(=O)OC)CC(=O)OC)C(=C3CC(=O)OC)CCC(=O)OC)C.[Zn+2]

Isomeric SMILES

CC1=C(C2=CC3=NC(=CC4=NC(=CC5=NC(=C(C5(C)C)[O-])C=C1[N-]2)C(=C4CCC(=O)OC)CC(=O)OC)C(=C3CC(=O)OC)CCC(=O)OC)C.[Zn+2]

InChI

InChI=1S/C38H41N4O9.Zn/c1-19-20(2)26-16-31-37(47)38(3,4)32(42-31)18-30-24(14-36(46)51-8)22(10-12-34(44)49-6)28(41-30)17-27-21(9-11-33(43)48-5)23(13-35(45)50-7)29(40-27)15-25(19)39-26;/h15-18H,9-14H2,1-8H3,(H-,39,40,41,42,47);/q-1;+2/p-1