butyl 4-oxidanylidene-3H-phthalazine-1-carboxylate

Systemtic Name: butyl 4-oxidanylidene-3H-phthalazine-1-carboxylate Openeye Name: butyl 4-oxo-3H-phthalazine-1-carboxylate CAS Name: 4-oxo-3H-phthalazine-1-carboxylic acid butyl ester IUPAC Name: butyl 4-oxo-3H-phthalazine-1-carboxylate Traditional Name: 4-keto-3H-phthalazine-1-carboxylic acid butyl ester Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=NNC(=O)C2=CC=CC=C21

Isomeric SMILES

CCCCOC(=O)C1=NNC(=O)C2=CC=CC=C21

InChI

InChI=1S/C13H14N2O3/c1-2-3-8-18-13(17)11-9-6-4-5-7-10(9)12(16)15-14-11/h4-7H,2-3,8H2,1H3,(H,15,16)