phenacyl 2-[4-[4-(4-phenacyloxycarbonylquinolin-2-yl)phenoxy]phenyl]quinoline-4-carboxylate

Systemtic Name: phenacyl 2-[4-[4-(4-phenacyloxycarbonylquinolin-2-yl)phenoxy]phenyl]quinoline-4-carboxylate Openeye Name: phenacyl 2-[4-[4-(4-phenacyloxycarbonyl-2-quinolyl)phenoxy]phenyl]quinoline-4-carboxylate CAS Name: 2-[4-[4-[4-[oxo(phenacyloxy)methyl]-2-quinolinyl]phenoxy]phenyl]-4-quinolinecarboxylic acid phenacyl ester IUPAC Name: phenacyl 2-[4-[4-(4-phenacyloxycarbonylquinolin-2-yl)phenoxy]phenyl]quinoline-4-carboxylate Traditional Name: 2-[4-[4-(4-phenacyloxycarbonyl-2-quinolyl)phenoxy]phenyl]cinchoninic acid phenacyl ester Formula: C48H32N2O7 MolecularWeight: 748.77688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)OC5=CC=C(C=C5)C6=NC7=CC=CC=C7C(=C6)C(=O)OCC(=O)C8=CC=CC=C8

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)OC5=CC=C(C=C5)C6=NC7=CC=CC=C7C(=C6)C(=O)OCC(=O)C8=CC=CC=C8

InChI

InChI=1S/C48H32N2O7/c51-45(33-11-3-1-4-12-33)29-55-47(53)39-27-43(49-41-17-9-7-15-37(39)41)31-19-23-35(24-20-31)57-36-25-21-32(22-26-36)44-28-40(38-16-8-10-18-42(38)50-44)48(54)56-30-46(52)34-13-5-2-6-14-34/h1-28H,29-30H2