methyl 1-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonyl-3,4-dihydro-2H-quinoline-5-carboxylate

Systemtic Name: methyl 1-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonyl-3,4-dihydro-2H-quinoline-5-carboxylate Openeye Name: methyl 1-(3-methyl-4-oxo-phthalazine-1-carbonyl)-3,4-dihydro-2H-quinoline-5-carboxylate CAS Name: 1-[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid methyl ester IUPAC Name: methyl 1-(3-methyl-4-oxophthalazine-1-carbonyl)-3,4-dihydro-2H-quinoline-5-carboxylate Traditional Name: 1-(4-keto-3-methyl-phthalazine-1-carbonyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid methyl ester Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCCC4=C(C=CC=C43)C(=O)OC

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCCC4=C(C=CC=C43)C(=O)OC

InChI

InChI=1S/C21H19N3O4/c1-23-19(25)15-8-4-3-7-14(15)18(22-23)20(26)24-12-6-10-13-16(21(27)28-2)9-5-11-17(13)24/h3-5,7-9,11H,6,10,12H2,1-2H3