(2-chloranyl-5-methyl-phenyl) 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate

Systemtic Name: (2-chloranyl-5-methyl-phenyl) 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate Openeye Name: (2-chloro-5-methyl-phenyl) 4-oxo-3-propyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-propyl-1-phthalazinecarboxylic acid (2-chloro-5-methylphenyl) ester IUPAC Name: (2-chloro-5-methylphenyl) 4-oxo-3-propylphthalazine-1-carboxylate Traditional Name: 4-keto-3-propyl-phthalazine-1-carboxylic acid (2-chloro-5-methyl-phenyl) ester Formula: C19H17ClN2O3 MolecularWeight: 356.80288

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=C(C=CC(=C3)C)Cl

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=C(C=CC(=C3)C)Cl

InChI

InChI=1S/C19H17ClN2O3/c1-3-10-22-18(23)14-7-5-4-6-13(14)17(21-22)19(24)25-16-11-12(2)8-9-15(16)20/h4-9,11H,3,10H2,1-2H3