methyl 3-[15-(3-methoxy-3-oxidanylidene-propyl)-10-(1-methylimidazol-2-yl)-20-phenyl-21,24-dihydroporphyrin-5-yl]propanoate

Systemtic Name: methyl 3-[15-(3-methoxy-3-oxidanylidene-propyl)-10-(1-methylimidazol-2-yl)-20-phenyl-21,24-dihydroporphyrin-5-yl]propanoate Openeye Name: methyl 3-[15-(3-methoxy-3-oxo-propyl)-10-(1-methylimidazol-2-yl)-20-phenyl-21,24-dihydroporphyrin-5-yl]propanoate CAS Name: 3-[15-(3-methoxy-3-oxopropyl)-10-(1-methyl-2-imidazolyl)-20-phenyl-21,24-dihydroporphyrin-5-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[15-(3-methoxy-3-oxopropyl)-10-(1-methylimidazol-2-yl)-20-phenyl-21,24-dihydroporphyrin-5-yl]propanoate Traditional Name: 3-[15-(3-keto-3-methoxy-propyl)-10-(1-methylimidazol-2-yl)-20-phenyl-21,24-dihydroporphin-5-yl]propionic acid methyl ester Formula: C38H34N6O4 MolecularWeight: 638.71436

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)CCC(=O)OC)C7=CC=CC=C7)N4)CCC(=O)OC

Isomeric SMILES

CN1C=CN=C1C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)CCC(=O)OC)C7=CC=CC=C7)N4)CCC(=O)OC

InChI

InChI=1S/C38H34N6O4/c1-44-22-21-39-38(44)37-32-17-13-28(42-32)24(9-19-34(45)47-2)26-11-15-30(40-26)36(23-7-5-4-6-8-23)31-16-12-27(41-31)25(10-20-35(46)48-3)29-14-18-33(37)43-29/h4-8,11-18,21-22,40-41H,9-10,19-20H2,1-3H3