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

Systemtic Name: (2-chloranyl-5-methyl-phenyl) 3-butyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (2-chloro-5-methyl-phenyl) 3-butyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-butyl-4-oxo-1-phthalazinecarboxylic acid (2-chloro-5-methylphenyl) ester IUPAC Name: (2-chloro-5-methylphenyl) 3-butyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-butyl-4-keto-phthalazine-1-carboxylic acid (2-chloro-5-methyl-phenyl) ester Formula: C20H19ClN2O3 MolecularWeight: 370.82946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=C(C=CC(=C3)C)Cl

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=C(C=CC(=C3)C)Cl

InChI

InChI=1S/C20H19ClN2O3/c1-3-4-11-23-19(24)15-8-6-5-7-14(15)18(22-23)20(25)26-17-12-13(2)9-10-16(17)21/h5-10,12H,3-4,11H2,1-2H3