copper (Z)-[10,20-bis(3-methoxyphenyl)porphyrin-22-id-5-ylidene]methanolate

Systemtic Name: copper (Z)-[10,20-bis(3-methoxyphenyl)porphyrin-22-id-5-ylidene]methanolate Openeye Name: copper (Z)-[10,20-bis(3-methoxyphenyl)porphyrin-22-id-5-ylidene]methanolate CAS Name: copper (Z)-[10,20-bis(3-methoxyphenyl)-5-porphyrin-22-idylidene]methanolate IUPAC Name: copper (Z)-[10,20-bis(3-methoxyphenyl)porphyrin-22-id-5-ylidene]methanolate Traditional Name: cupric (Z)-[10,20-bis(3-methoxyphenyl)porphin-22-id-5-ylidene]methanolate Formula: C35H24CuN4O3 MolecularWeight: 612.13606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C3C=CC(=N3)C=C4C=CC(=N4)C(=C5C=CC(=N5)C(=C[O-])C6=CC=C2[N-]6)C7=CC(=CC=C7)OC.[Cu+2]

Isomeric SMILES

COC1=CC=CC(=C1)C2=C3C=CC(=N3)C=C4C=CC(=N4)C(=C5C=CC(=N5)/C(=C\[O-])/C6=CC=C2[N-]6)C7=CC(=CC=C7)OC.[Cu+2]

InChI

InChI=1S/C35H25N4O3.Cu/c1-41-25-7-3-5-21(17-25)34-30-11-9-23(36-30)19-24-10-12-31(37-24)35(22-6-4-8-26(18-22)42-2)33-16-14-29(39-33)27(20-40)28-13-15-32(34)38-28;/h3-20H,1-2H3,(H-,36,37,38,39,40);/q-1;+2/p-1