methyl 2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoyloxymethyl]-4-phenyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoyloxymethyl]-4-phenyl-quinoline-3-carboxylate Openeye Name: methyl 2-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]oxymethyl]-4-phenyl-quinoline-3-carboxylate CAS Name: 2-[[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethoxy]methyl]-4-phenyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]oxymethyl]-4-phenylquinoline-3-carboxylate Traditional Name: 2-[[2-(4-keto-3H-phthalazin-1-yl)acetyl]oxymethyl]-4-phenyl-quinoline-3-carboxylic acid methyl ester Formula: C28H21N3O5 MolecularWeight: 479.48344

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)CC3=NNC(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)CC3=NNC(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C28H21N3O5/c1-35-28(34)26-23(29-21-14-8-7-13-20(21)25(26)17-9-3-2-4-10-17)16-36-24(32)15-22-18-11-5-6-12-19(18)27(33)31-30-22/h2-14H,15-16H2,1H3,(H,31,33)