naphthalen-1-ylmethyl 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: naphthalen-1-ylmethyl 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 1-naphthylmethyl 3-methyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-methyl-4-oxo-1-phthalazinecarboxylic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 3-methyl-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-methyl-phthalazine-1-carboxylic acid 1-naphthylmethyl ester Formula: C21H16N2O3 MolecularWeight: 344.36334

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H16N2O3/c1-23-20(24)18-12-5-4-11-17(18)19(22-23)21(25)26-13-15-9-6-8-14-7-2-3-10-16(14)15/h2-12H,13H2,1H3