(phenylmethyl) 3-hexyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (phenylmethyl) 3-hexyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: benzyl 3-hexyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-hexyl-4-oxo-1-phthalazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-hexyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-hexyl-4-keto-phthalazine-1-carboxylic acid benzyl ester Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O3/c1-2-3-4-10-15-24-21(25)19-14-9-8-13-18(19)20(23-24)22(26)27-16-17-11-6-5-7-12-17/h5-9,11-14H,2-4,10,15-16H2,1H3