[5-(4-chlorophenyl)-1,3-oxazol-2-yl]methyl 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: [5-(4-chlorophenyl)-1,3-oxazol-2-yl]methyl 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: [5-(4-chlorophenyl)oxazol-2-yl]methyl 3-methyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-methyl-4-oxo-1-phthalazinecarboxylic acid [5-(4-chlorophenyl)-2-oxazolyl]methyl ester IUPAC Name: [5-(4-chlorophenyl)-1,3-oxazol-2-yl]methyl 3-methyl-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-methyl-phthalazine-1-carboxylic acid [5-(4-chlorophenyl)oxazol-2-yl]methyl ester Formula: C20H14ClN3O4 MolecularWeight: 395.79586

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=NC=C(O3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=NC=C(O3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H14ClN3O4/c1-24-19(25)15-5-3-2-4-14(15)18(23-24)20(26)27-11-17-22-10-16(28-17)12-6-8-13(21)9-7-12/h2-10H,11H2,1H3