butyl 4-(4-oxidanylidene-3H-phthalazin-1-yl)benzoate

Systemtic Name: butyl 4-(4-oxidanylidene-3H-phthalazin-1-yl)benzoate Openeye Name: butyl 4-(4-oxo-3H-phthalazin-1-yl)benzoate CAS Name: 4-(4-oxo-3H-phthalazin-1-yl)benzoic acid butyl ester IUPAC Name: butyl 4-(4-oxo-3H-phthalazin-1-yl)benzoate Traditional Name: 4-(4-keto-3H-phthalazin-1-yl)benzoic acid butyl ester Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H18N2O3/c1-2-3-12-24-19(23)14-10-8-13(9-11-14)17-15-6-4-5-7-16(15)18(22)21-20-17/h4-11H,2-3,12H2,1H3,(H,21,22)