zinc 17-methoxy-7,13-bis(2-methoxy-2-oxidanylidene-ethyl)-8,12-bis(3-methoxy-3-oxidanylidene-propyl)-3,3,17,18-tetramethyl-18-oxidanyl-porphyrin-23-id-2-olate

Systemtic Name: zinc 17-methoxy-7,13-bis(2-methoxy-2-oxidanylidene-ethyl)-8,12-bis(3-methoxy-3-oxidanylidene-propyl)-3,3,17,18-tetramethyl-18-oxidanyl-porphyrin-23-id-2-olate Openeye Name: zinc 18-hydroxy-17-methoxy-7,13-bis(2-methoxy-2-oxo-ethyl)-8,12-bis(3-methoxy-3-oxo-propyl)-3,3,17,18-tetramethyl-porphyrin-23-id-2-olate CAS Name: zinc 18-hydroxy-17-methoxy-7,13-bis(2-methoxy-2-oxoethyl)-8,12-bis(3-methoxy-3-oxopropyl)-3,3,17,18-tetramethyl-2-porphyrin-23-idolate IUPAC Name: zinc 18-hydroxy-17-methoxy-7,13-bis(2-methoxy-2-oxoethyl)-8,12-bis(3-methoxy-3-oxopropyl)-3,3,17,18-tetramethylporphyrin-23-id-2-olate Traditional Name: zinc 18-hydroxy-7,13-bis(2-keto-2-methoxy-ethyl)-8,12-bis(3-keto-3-methoxy-propyl)-17-methoxy-3,3,17,18-tetramethyl-porphin-23-id-2-olate Formula: C39H44N4O11Zn MolecularWeight: 810.19586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=NC(=C1[O-])C=C3C(C(C(=N3)C=C4C(=C(C(=CC5=NC(=C2)C(=C5CCC(=O)OC)CC(=O)OC)[N-]4)CCC(=O)OC)CC(=O)OC)(C)OC)(C)O)C.[Zn+2]

Isomeric SMILES

CC1(C2=NC(=C1[O-])C=C3C(C(C(=N3)C=C4C(=C(C(=CC5=NC(=C2)C(=C5CCC(=O)OC)CC(=O)OC)[N-]4)CCC(=O)OC)CC(=O)OC)(C)OC)(C)O)C.[Zn+2]

InChI

InChI=1S/C39H45N4O11.Zn/c1-37(2)29-17-26-22(14-34(46)52-7)20(10-12-32(44)50-5)24(40-26)16-25-21(11-13-33(45)51-6)23(15-35(47)53-8)27(41-25)18-31-39(4,54-9)38(3,49)30(43-31)19-28(42-29)36(37)48;/h16-19,49H,10-15H2,1-9H3,(H-,40,41,42,43,48);/q-1;+2/p-1