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

Systemtic Name: methyl 2-[2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanoyloxymethyl]-4-methyl-quinoline-3-carboxylate Openeye Name: methyl 2-[[2-(1,4-dioxo-3H-phthalazin-2-yl)acetyl]oxymethyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[2-(1,4-dioxo-3H-phthalazin-2-yl)-1-oxoethoxy]methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(1,4-dioxo-3H-phthalazin-2-yl)acetyl]oxymethyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[[2-(1,4-diketo-3H-phthalazin-2-yl)acetyl]oxymethyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C23H19N3O6 MolecularWeight: 433.41346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CN3C(=O)C4=CC=CC=C4C(=O)N3)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CN3C(=O)C4=CC=CC=C4C(=O)N3)C(=O)OC

InChI

InChI=1S/C23H19N3O6/c1-13-14-7-5-6-10-17(14)24-18(20(13)23(30)31-2)12-32-19(27)11-26-22(29)16-9-4-3-8-15(16)21(28)25-26/h3-10H,11-12H2,1-2H3,(H,25,28)