(3,4-dichlorophenyl) 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate

Systemtic Name: (3,4-dichlorophenyl) 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate Openeye Name: (3,4-dichlorophenyl) 4-oxo-3-propyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-propyl-1-phthalazinecarboxylic acid (3,4-dichlorophenyl) ester IUPAC Name: (3,4-dichlorophenyl) 4-oxo-3-propylphthalazine-1-carboxylate Traditional Name: 4-keto-3-propyl-phthalazine-1-carboxylic acid (3,4-dichlorophenyl) ester Formula: C18H14Cl2N2O3 MolecularWeight: 377.22136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14Cl2N2O3/c1-2-9-22-17(23)13-6-4-3-5-12(13)16(21-22)18(24)25-11-7-8-14(19)15(20)10-11/h3-8,10H,2,9H2,1H3